############################################################### ############################################################### ############################################################### ### CCP4 6.1: MTZDUMP version 6.1 : 03/03/08## ############################################################### User: gpelios Run date: 1/ 3/2010 Run time: 05:48:37 Please reference: Collaborative Computational Project, Number 4. 1994. "The CCP4 Suite: Programs for Protein Crystallography". Acta Cryst. D50, 760-763. as well as any specific reference in the program write-up.OPENED INPUT MTZ FILE Logical Name: HKLIN Filename: rnasa-1.8-all_refmac1.mtz Spacegroup information obtained from library file: Logical Name: SYMINFO Filename: /home/gpelios/ccp4-6.1.3/lib/data/syminfo.lib * Title: Output mtz file from refmac. * Base dataset: 0 HKL_base HKL_base HKL_base * Number of Datasets = 2 * Dataset ID, project/crystal/dataset names, cell dimensions, wavelength: 1 RNASE RNASE NATIVE 64.8970 78.3230 38.7920 90.0000 90.0000 90.0000 0.00000 2 RNASE3GMP RNASE3GMP COMPLEX 64.8970 78.3230 38.7920 90.0000 90.0000 90.0000 0.00000 * Number of Columns = 13 * Number of Reflections = 17939 * Missing value set to NaN in input mtz file * HISTORY for current MTZ file : * Column Labels : H K L FreeR_flag FGMP18 SIGFGMP18 FC PHIC FWT PHWT DELFWT PHDELWT FOM * Column Types : H H H I F Q F P F P F P W * Associated datasets : 0 0 0 1 2 2 2 2 2 2 2 2 2 * Cell Dimensions : (obsolete - refer to dataset cell dimensions above) 64.8970 78.3230 38.7920 90.0000 90.0000 90.0000 * Resolution Range : 0.00377 0.29751 ( 16.287 - 1.833 A ) * Sort Order : 1 2 3 0 0 * Space group = 'P212121' (number 19) OVERALL FILE STATISTICS for resolution range 0.004 - 0.298 ======================= Col Sort Min Max Num % Mean Mean Resolution Type Column num order Missing complete abs. Low High label 1 ASC 0 35 0 100.00 13.1 13.1 16.28 1.83 H H 2 NONE 0 42 0 100.00 15.9 15.9 16.28 1.83 H K 3 NONE 0 21 0 100.00 7.7 7.7 16.28 1.83 H L 4 NONE 1.7 857.1 915 94.90 130.80 130.80 16.28 1.85 F FGMP18 5 NONE 1.8 56.8 915 94.90 6.95 6.95 16.28 1.85 Q SIGFGMP18 6 NONE 0.0 19.0 0 100.00 9.49 9.49 16.28 1.83 I FreeR_flag 7 NONE 0.0 3741.8 0 100.00 138.88 138.88 16.28 1.83 F FC 8 NONE 0.0 360.0 0 100.00 179.74 179.74 16.28 1.83 P PHIC 9 NONE 0.0 1025.3 0 100.00 121.79 121.79 16.28 1.83 F FWT 10 NONE 0.0 360.0 0 100.00 180.82 180.82 16.28 1.83 P PHWT 11 NONE 0.0 369.9 0 100.00 23.58 23.58 16.28 1.83 F DELFWT 12 NONE 0.0 360.0 0 100.00 162.33 162.33 16.28 1.83 P PHDELWT 13 NONE 0.000 1.000 0 100.00 0.762 0.762 16.28 1.83 W FOM No. of reflections used in FILE STATISTICS 17939 LIST OF REFLECTIONS =================== 0 0 4 292.07 23.78 19.00 1551.92 180.00 111.50 180.00 180.57 0.00 1.00 0 0 6 626.58 49.59 17.00 669.89 0.00 690.42 0.00 63.84 0.00 1.00 0 0 8 489.00 38.28 8.00 357.94 0.00 572.06 0.00 83.06 0.00 1.00 0 0 10 57.67 15.38 9.00 130.19 0.00 107.81 180.00 143.41 180.00 0.62 0 0 12 259.93 21.26 11.00 146.32 0.00 264.15 0.00 4.25 0.00 1.00 0 0 14 77.79 12.64 18.00 93.22 0.00 3.23 0.00 46.89 180.00 0.64 0 0 16 89.14 14.69 4.00 27.67 0.00 35.62 360.00 8.31 360.00 0.31 0 0 18 249.87 20.74 11.00 298.56 180.00 214.77 180.00 35.10 0.00 1.00 0 0 20 29.90 29.90 13.00 12.73 0.00 0.70 360.00 5.65 180.00 0.21 0 1 3 149.26 4.75 6.00 150.24 270.00 175.35 90.00 57.72 90.00 0.79 MTZDUMP: Normal termination of mtzdump Times: User: 0.0s System: 0.0s Elapsed: 0:03