unknownINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP36 INTEGRATEMon Dec 27 18:57:19 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_1_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 65.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004010 0.001559 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.40 101.40 101.40 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 33.512 1.531 NUMBER OF TRUSTED DETECTOR PIXELS 5612857 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 51.270 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 1.00 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP36_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP36 CORRECTMon Dec 27 19:58:04 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.398 101.398 101.398 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 33.450 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 65.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004010 0.001559 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 406.833 ORGX= 1273.59 ORGY= 1288.40 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.030 REFLECTING_RANGE_E.S.D.= 0.191 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 9816 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 9816 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 1 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP36_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP37 INTEGRATEMon Dec 27 18:59:04 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_2_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 65.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003914 0.001674 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.86 101.86 101.86 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 35.950 1.532 NUMBER OF TRUSTED DETECTOR PIXELS 5618140 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 81.752 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP37_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP37 CORRECTMon Dec 27 20:01:46 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.864 101.864 101.864 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 35.910 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 65.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003914 0.001674 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 407.128 ORGX= 1273.40 ORGY= 1288.13 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.030 REFLECTING_RANGE_E.S.D.= 0.132 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 10101 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 10101 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 4 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP37_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP34 INTEGRATEMon Dec 27 19:01:10 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_8_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 136.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003805 0.001605 1.021860 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 102.02 102.02 102.02 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 44.114 1.401 NUMBER OF TRUSTED DETECTOR PIXELS 5624627 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 349.792 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP34_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP34 CORRECTMon Dec 27 20:08:28 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 102.015 102.015 102.015 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 44.030 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 136.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003805 0.001605 1.021860 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.534 ORGX= 1272.01 ORGY= 1288.44 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.040 REFLECTING_RANGE_E.S.D.= 0.162 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 27678 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 27678 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 198 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP34_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP35 INTEGRATEMon Dec 27 19:03:27 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_9_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 148.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003410 0.001241 1.021862 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.69 101.69 101.69 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 36.931 1.399 NUMBER OF TRUSTED DETECTOR PIXELS 5622536 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 336.093 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP35_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP35 CORRECTMon Dec 27 20:06:43 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.689 101.689 101.689 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 36.910 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 148.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003410 0.001241 1.021862 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 356.667 ORGX= 1271.16 ORGY= 1289.15 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.038 REFLECTING_RANGE_E.S.D.= 0.144 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 27347 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 27347 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 381 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP35_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP32 INTEGRATEMon Dec 27 19:05:58 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_6_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 142.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003773 0.001594 1.021860 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.93 101.93 101.93 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 46.223 1.401 NUMBER OF TRUSTED DETECTOR PIXELS 5625231 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 351.571 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP32_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP32 CORRECTMon Dec 27 20:03:50 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.932 101.932 101.932 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 46.210 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 142.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003773 0.001594 1.021860 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.689 ORGX= 1271.96 ORGY= 1288.43 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.032 REFLECTING_RANGE_E.S.D.= 0.133 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 27738 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 27738 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 2187 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP32_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP33 INTEGRATEMon Dec 27 19:09:08 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_7_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 114.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003884 0.001245 1.021860 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 102.13 102.13 102.13 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 32.435 1.402 NUMBER OF TRUSTED DETECTOR PIXELS 5620010 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 358.369 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP33_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP33 CORRECTMon Dec 27 19:58:37 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 102.133 102.133 102.133 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 32.360 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 114.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003884 0.001245 1.021860 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.710 ORGX= 1272.14 ORGY= 1289.22 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.036 REFLECTING_RANGE_E.S.D.= 0.119 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 27918 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 27918 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 19 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP33_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP31 INTEGRATEMon Dec 27 19:11:02 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_5_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 156.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004081 0.001743 1.021858 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.87 101.87 101.87 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 54.226 1.401 NUMBER OF TRUSTED DETECTOR PIXELS 5626433 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 322.662 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP31_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP31 CORRECTMon Dec 27 19:55:30 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.869 101.869 101.869 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 54.110 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 156.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004081 0.001743 1.021858 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.396 ORGX= 1272.51 ORGY= 1288.13 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.032 REFLECTING_RANGE_E.S.D.= 0.117 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 13627 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 13627 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 77 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP31_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP38 INTEGRATEMon Dec 27 19:12:52 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_3_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 71.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004151 0.001176 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.56 101.56 101.56 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 36.338 1.400 NUMBER OF TRUSTED DETECTOR PIXELS 5622219 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 79.868 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP38_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP38 CORRECTMon Dec 27 20:05:49 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.560 101.560 101.560 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 36.340 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 71.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004151 0.001176 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 356.966 ORGX= 1272.65 ORGY= 1289.31 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.026 REFLECTING_RANGE_E.S.D.= 0.103 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 13620 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 13620 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 278 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP38_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP39 INTEGRATEMon Dec 27 19:14:54 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_4_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 57.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004085 0.001474 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.41 101.41 101.41 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 31.271 1.466 NUMBER OF TRUSTED DETECTOR PIXELS 5615883 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 80.053 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP39_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP39 CORRECTMon Dec 27 19:55:46 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.414 101.414 101.414 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 31.250 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 57.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004085 0.001474 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 382.390 ORGX= 1273.13 ORGY= 1288.67 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.043 REFLECTING_RANGE_E.S.D.= 0.158 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 11282 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 11282 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 7 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP39_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP19 INTEGRATEMon Dec 27 19:17:06 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_7_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 7.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004134 0.001379 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.17 101.17 101.17 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 47.457 1.463 NUMBER OF TRUSTED DETECTOR PIXELS 5616081 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 168.590 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP19_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP19 CORRECTMon Dec 27 19:57:10 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.165 101.165 101.165 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 47.410 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 7.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004134 0.001379 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 380.981 ORGX= 1273.21 ORGY= 1288.82 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.040 REFLECTING_RANGE_E.S.D.= 0.233 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 22940 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 22940 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 294 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP19_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP14 INTEGRATEMon Dec 27 19:19:41 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_2_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004271 0.001576 1.021858 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.73 101.73 101.73 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 37.882 1.271 NUMBER OF TRUSTED DETECTOR PIXELS 5611128 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 195.459 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP14_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP14 CORRECTMon Dec 27 20:07:09 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.732 101.732 101.732 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 37.880 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004271 0.001576 1.021858 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 306.335 ORGX= 1271.74 ORGY= 1288.86 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.030 REFLECTING_RANGE_E.S.D.= 0.080 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 38647 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 38647 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 40 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP14_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP15 INTEGRATEMon Dec 27 19:21:48 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_3_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 7.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003317 0.001115 1.021862 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.37 101.37 101.37 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 40.482 1.465 NUMBER OF TRUSTED DETECTOR PIXELS 5617266 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 157.563 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP15_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP15 CORRECTMon Dec 27 19:59:28 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.370 101.370 101.370 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 40.540 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 7.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003317 0.001115 1.021862 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 382.049 ORGX= 1271.21 ORGY= 1289.52 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.037 REFLECTING_RANGE_E.S.D.= 0.147 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 23159 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 23159 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 177 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP15_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP13 INTEGRATEMon Dec 27 19:24:12 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_1_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 7.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003907 0.001437 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.69 101.69 101.69 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 37.598 1.271 NUMBER OF TRUSTED DETECTOR PIXELS 5610835 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 184.879 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP13_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP13 CORRECTMon Dec 27 19:57:52 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.692 101.692 101.692 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 37.580 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 7.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003907 0.001437 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 306.288 ORGX= 1271.04 ORGY= 1289.11 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.038 REFLECTING_RANGE_E.S.D.= 0.111 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 38352 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 38352 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 23 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP13_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP8 INTEGRATEMon Dec 27 19:26:36 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_15_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004641 0.001412 1.021856 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.65 101.65 101.65 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 43.344 1.336 NUMBER OF TRUSTED DETECTOR PIXELS 5617065 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 224.108 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP8_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP8 CORRECTMon Dec 27 19:56:45 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.647 101.647 101.647 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 43.330 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004641 0.001412 1.021856 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 331.960 ORGX= 1273.06 ORGY= 1289.01 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.037 REFLECTING_RANGE_E.S.D.= 0.217 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 31780 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 31780 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 197 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP8_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP4 INTEGRATEMon Dec 27 19:28:26 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_11_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004071 0.001731 1.021858 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.78 101.78 101.78 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 40.957 1.400 NUMBER OF TRUSTED DETECTOR PIXELS 5620112 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 240.016 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP4_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP4 CORRECTMon Dec 27 19:58:15 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.777 101.777 101.777 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 40.890 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004071 0.001731 1.021858 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.275 ORGX= 1272.53 ORGY= 1288.17 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.039 REFLECTING_RANGE_E.S.D.= 0.093 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 13654 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 13654 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 3 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP4_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP5 INTEGRATEMon Dec 27 19:30:11 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_12_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004134 0.001352 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.76 101.76 101.76 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 50.073 1.336 NUMBER OF TRUSTED DETECTOR PIXELS 5621440 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 262.706 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP5_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP5 CORRECTMon Dec 27 19:56:17 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.763 101.763 101.763 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 49.950 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004134 0.001352 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 332.087 ORGX= 1272.11 ORGY= 1289.13 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.037 REFLECTING_RANGE_E.S.D.= 0.128 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 15856 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 15856 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 4 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP5_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP42 INTEGRATEMon Dec 27 19:31:58 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_7_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 65.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004330 0.001399 1.021858 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.52 101.52 101.52 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 27.793 1.400 NUMBER OF TRUSTED DETECTOR PIXELS 5616010 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 119.611 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP42_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP42 CORRECTMon Dec 27 20:07:20 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.517 101.517 101.517 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 27.780 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 65.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004330 0.001399 1.021858 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.150 ORGX= 1273.03 ORGY= 1288.92 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.032 REFLECTING_RANGE_E.S.D.= 0.128 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 13448 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 13448 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 3 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP42_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP41 INTEGRATEMon Dec 27 19:33:42 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_6_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 69.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004232 0.001187 1.021858 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.24 101.24 101.24 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 47.611 1.400 NUMBER OF TRUSTED DETECTOR PIXELS 5621156 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 105.965 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP41_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP41 CORRECTMon Dec 27 19:57:28 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.241 101.241 101.241 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 47.600 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 69.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004232 0.001187 1.021858 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 356.926 ORGX= 1272.81 ORGY= 1289.36 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.023 REFLECTING_RANGE_E.S.D.= 0.072 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 13702 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 13702 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 43 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP41_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP40 INTEGRATEMon Dec 27 19:35:26 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_5_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 63.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004302 0.001332 1.021858 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.33 101.33 101.33 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 32.465 1.466 NUMBER OF TRUSTED DETECTOR PIXELS 5617075 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 87.855 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP40_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP40 CORRECTMon Dec 27 20:07:29 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.325 101.325 101.325 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 32.490 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD4_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 63.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004302 0.001332 1.021858 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 382.243 ORGX= 1273.58 ORGY= 1289.00 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.029 REFLECTING_RANGE_E.S.D.= 0.189 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 11281 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 11281 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 6 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP40_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP29 INTEGRATEMon Dec 27 19:37:31 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_3_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 140.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004176 0.000979 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.85 101.85 101.85 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 36.485 1.402 NUMBER OF TRUSTED DETECTOR PIXELS 5620928 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 232.295 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP29_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP29 CORRECTMon Dec 27 20:07:50 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.854 101.854 101.854 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 36.480 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 140.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004176 0.000979 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.696 ORGX= 1272.75 ORGY= 1289.57 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.029 REFLECTING_RANGE_E.S.D.= 0.079 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 27854 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 1 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 27853 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 20 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP29_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP28 INTEGRATEMon Dec 27 19:39:47 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_2_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 130.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004383 0.001358 1.021858 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.76 101.76 101.76 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 48.332 1.271 NUMBER OF TRUSTED DETECTOR PIXELS 5621464 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 316.543 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP28_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP28 CORRECTMon Dec 27 20:01:24 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.759 101.759 101.759 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 48.350 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 130.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004383 0.001358 1.021858 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 306.281 ORGX= 1271.97 ORGY= 1289.19 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.028 REFLECTING_RANGE_E.S.D.= 0.076 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 38842 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 38842 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 716 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP28_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP21 INTEGRATEMon Dec 27 19:41:55 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_9_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003922 0.001424 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.30 101.30 101.30 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 28.179 1.465 NUMBER OF TRUSTED DETECTOR PIXELS 5608796 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 186.949 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP21_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP21 CORRECTMon Dec 27 20:05:04 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.295 101.295 101.295 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 28.140 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD2_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 5.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003922 0.001424 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 381.972 ORGX= 1272.59 ORGY= 1288.79 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.035 REFLECTING_RANGE_E.S.D.= 0.150 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 11386 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 11386 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 5 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP21_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP23 INTEGRATEMon Dec 27 19:43:53 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_11_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 136.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004631 0.001681 1.021856 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.68 101.68 101.68 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 42.724 1.530 NUMBER OF TRUSTED DETECTOR PIXELS 5621676 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 228.323 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP23_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP23 CORRECTMon Dec 27 20:01:36 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.683 101.683 101.683 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 42.620 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 136.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004631 0.001681 1.021856 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 406.323 ORGX= 1275.03 ORGY= 1288.18 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.041 REFLECTING_RANGE_E.S.D.= 0.183 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 9838 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 9838 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 4 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP23_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP25 INTEGRATEMon Dec 27 19:46:32 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_13_1_???.cbf CBF DATA_RANGE= 1 100 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= -41.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003887 0.000966 1.021860 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.77 101.77 101.77 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 43.038 1.465 NUMBER OF TRUSTED DETECTOR PIXELS 5623362 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 491.312 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP25_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP25 CORRECTMon Dec 27 20:09:22 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.772 101.772 101.772 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 43.080 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 100 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= -41.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003887 0.000966 1.021860 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 381.713 ORGX= 1272.77 ORGY= 1289.73 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.034 REFLECTING_RANGE_E.S.D.= 0.216 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 19657 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 100 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 19657 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 134 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP25_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP24 INTEGRATEMon Dec 27 19:48:41 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_12_1_???.cbf CBF DATA_RANGE= 1 60 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= -38.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.003973 0.001734 1.021859 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 102.02 102.02 102.02 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 31.363 1.401 NUMBER OF TRUSTED DETECTOR PIXELS 5619356 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 435.764 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP24_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP24 CORRECTMon Dec 27 19:56:00 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 102.020 102.020 102.020 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 31.300 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 60 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= -38.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.003973 0.001734 1.021859 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.410 ORGX= 1272.29 ORGY= 1288.20 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.045 REFLECTING_RANGE_E.S.D.= 0.160 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 13393 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 60 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 13393 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 6 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP24_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP27 INTEGRATEMon Dec 27 19:50:55 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_1_1_???.cbf CBF DATA_RANGE= 1 120 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= 137.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.002902 0.000994 1.021863 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.65 101.65 101.65 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 37.346 1.399 NUMBER OF TRUSTED DETECTOR PIXELS 5617508 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 177.386 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.99 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP27_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP27 CORRECTMon Dec 27 20:00:06 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.648 101.648 101.648 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 37.310 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 120 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= 137.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.002902 0.000994 1.021863 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 356.864 ORGX= 1270.02 ORGY= 1289.62 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.039 REFLECTING_RANGE_E.S.D.= 0.168 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 27234 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 120 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 27234 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 110 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP27_CORRECT.logINTEGRATE.LPAUTOMATIC DEFAULT NATIVE SWEEP26 INTEGRATEMon Dec 27 19:53:57 2010PROFILE_FITTING= TRUE NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_14_1_???.cbf CBF DATA_RANGE= 1 100 NX= 2463 NY= 2527 QX= 0.17200 QY= 0.17200 MINIMUM_VALID_PIXEL_VALUE= 0 OVERLOAD= 1048500 BACKGROUND_PIXEL= 6.00 SIGNAL_PIXEL= 3.00 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINPK= 75.00 STARTING_ANGLE= -31.000 STARTING_FRAME= 1 OSCILLATION_RANGE= 0.100000 DEGREES ROTATION_AXIS= 1.00000 0.00000 0.00000 X-RAY_WAVELENGTH= 0.97860 ANGSTROM INCIDENT_BEAM_DIRECTION= -0.004099 0.001686 1.021858 SPACE_GROUP_NUMBER= 197 UNIT_CELL_CONSTANTS= 101.98 101.98 101.98 90.000 90.000 90.000 RESOLUTION RANGE RECORDED BY DETECTOR (ANGSTROM) 58.845 1.401 NUMBER OF TRUSTED DETECTOR PIXELS 5627002 MEAN CONTENTS OF TRUSTED PIXELS IN BACKGROUND TABLE 613.236 MEAN VALUE OF NON-XRAY BACKGROUND (OFFSET)= 0.00 NUMBER OF X-RAY COUNTS EQUIVALENT TO PIXEL CONTENTS IN A DATA IMAGE (PIXEL VALUE - OFFSET)/GAIN , WITH GAIN= 0.98 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP26_INTEGRATE.logCORRECT.LPAUTOMATIC DEFAULT NATIVE SWEEP26 CORRECTMon Dec 27 20:04:53 2010INPUT PARAMETER VALUES ---------------------- SPACE_GROUP_NUMBER= 197 as used in the INTEGRATE step UNIT_CELL_CONSTANTS= 101.978 101.978 101.978 90.000 90.000 90.000 as used by INTEGRATE FRIEDEL'S_LAW=TRUE PROFILE_FITTING= TRUE OVERLOAD= 1048500 MINPK= 75.0 WFAC1= 1.0 INCLUDE_RESOLUTION_RANGE= 58.650 0.000 NAME_TEMPLATE_OF_DATA_FRAMES=/scratch/gw56/polyhedra-mx6387-16/Am4/Am4_Nat_GD3_ DATA_RANGE= 1 100 ROTATION_AXIS= 1.000000 0.000000 0.000000 OSCILLATION_RANGE= 0.100000 STARTING_ANGLE= -31.000 STARTING_FRAME= 1 X-RAY_WAVELENGTH= 0.978600 INCIDENT_BEAM_DIRECTION= -0.004099 0.001686 1.021858 FRACTION_OF_POLARIZATION= 0.990 POLARIZATION_PLANE_NORMAL= 0.000000 0.000000 1.000000 AIR= 0.00100 SILICON= 3.696767 SENSOR_THICKNESS= 0.320000 DETECTOR=PILATUS DIRECTION_OF_DETECTOR_X-AXIS= 1.00000 0.00000 0.00000 DIRECTION_OF_DETECTOR_Y-AXIS= 0.00000 1.00000 0.00000 DETECTOR_DISTANCE= 357.456 ORGX= 1272.66 ORGY= 1288.29 NX= 2463 NY= 2527 QX= 0.172000 QY= 0.172000 BEAM_DIVERGENCE_E.S.D.= 0.031 REFLECTING_RANGE_E.S.D.= 0.140 MINIMUM_ZETA= 0.150 MAXIMUM_ERROR_OF_SPOT_POSITION= 3.0 MAXIMUM_ERROR_OF_SPINDLE_POSITION= 2.0 MINIMUM_I/SIGMA= 3.0 REFLECTIONS/CORRECTION_FACTOR= 50 STRICT_ABSORPTION_CORRECTION=FALSE CORRECTIONS= REFERENCE_DATA_SET= 23106 REFLECTIONS ON FILE "INTEGRATE.HKL" 0 CORRUPTED REFLECTION RECORDS (IGNORED) 0 REFLECTIONS INCOMPLETE OR OUTSIDE IMAGE RANGE 1 ... 100 0 OVERLOADED REFLECTIONS (IGNORED) 0 REFLECTIONS OUTSIDE ACCEPTED RESOLUTION RANGES OR TOO CLOSE TO ROTATION AXIS (IGNORED) 23106 REFLECTIONS ACCEPTED NUMBER OF UNIQUE REFLECTIONS IN FILE "REMOVE.HKL" 1005 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_SWEEP26_CORRECT.logXSCALE.LPAUTOMATIC DEFAULT XSCALEMon Dec 27 20:18:10 2010XSCALE (VERSION May 10, 2010) 27-Dec-2010 /home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_XSCALE.log866AUTOMATIC DEFAULT pointlessMon Dec 27 20:21:05 2010/home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_pointless.log898DEFAULT chef 1Mon Dec 27 20:23:40 2010/home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/DEFAULT_chef_1.log900AUTOMATIC DEFAULT scalaMon Dec 27 20:24:10 2010bins 20 resolution 1.807101 run 1 batch 1 to 120 resolution run 1 high 1.807101 run 2 batch 1001 to 1120 resolution run 2 high 1.807101 run 3 batch 2001 to 2119 resolution run 3 high 1.807101 run 4 batch 3001 to 3118 resolution run 4 high 1.807101 run 5 batch 4001 to 4059 resolution run 5 high 1.807101 run 6 batch 5001 to 5060 resolution run 6 high 1.807101 run 7 batch 6001 to 6059 resolution run 7 high 1.807101 run 8 batch 7001 to 7117 resolution run 8 high 1.807101 run 9 batch 8001 to 8119 resolution run 9 high 1.807101 run 10 batch 9001 to 9120 resolution run 10 high 1.807101 run 11 batch 10001 to 10120 resolution run 11 high 1.807101 run 12 batch 11001 to 11060 resolution run 12 high 1.807101 run 13 batch 12001 to 12119 resolution run 13 high 1.807101 run 14 batch 13001 to 13120 resolution run 14 high 1.807101 run 15 batch 14001 to 14119 resolution run 15 high 1.807101 run 16 batch 15001 to 15120 resolution run 16 high 1.807101 run 17 batch 16001 to 16059 resolution run 17 high 1.807101 run 18 batch 17001 to 17058 resolution run 18 high 1.807101 run 19 batch 18001 to 18098 resolution run 19 high 1.807101 run 20 batch 19001 to 19100 resolution run 20 high 1.807101 run 21 batch 20001 to 20059 resolution run 21 high 1.807101 run 22 batch 21001 to 21059 resolution run 22 high 1.807101 run 23 batch 22001 to 22060 resolution run 23 high 1.807101 run 24 batch 23001 to 23058 resolution run 24 high 1.807101 run 25 batch 24001 to 24058 resolution run 25 high 1.807101 run 26 batch 25001 to 25060 resolution run 26 high 1.807101 run 27 batch 26001 to 26060 resolution run 27 high 1.807101 name run 1 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 2 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 3 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 4 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 5 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 6 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 7 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 8 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 9 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 10 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 11 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 12 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 13 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 14 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 15 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 16 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 17 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 18 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 19 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 20 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 21 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 22 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 23 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 24 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 25 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 26 project AUTOMATIC crystal DEFAULT dataset NATIVE name run 27 project AUTOMATIC crystal DEFAULT dataset NATIVE scales constant exclude sdmin 2.0 sdcorrection fixsdb noadjust norefine both 1.0 0.0 anomalous off /home/gw56/ccp4/lunchtime_bytes/poly_three/DEFAULT/scale/AUTOMATIC_DEFAULT_sorted.mtz/home/gw56/ccp4/lunchtime_bytes/poly_three/DEFAULT/scale/AUTOMATIC_DEFAULT_scaled.mtz/home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_scala.log904AUTOMATIC DEFAULT NATIVE truncateMon Dec 27 20:24:44 2010anomalous no /home/gw56/ccp4/lunchtime_bytes/poly_three/DEFAULT/scale/AUTOMATIC_DEFAULT_scaled.mtz/home/gw56/ccp4/lunchtime_bytes/poly_three/DEFAULT/scale/NATIVE_truncated.mtz/home/gw56/ccp4/lunchtime_bytes/poly_three/LogFiles/AUTOMATIC_DEFAULT_NATIVE_truncate.log