Experiment | |
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Method _exptl.method | X-RAY DIFFRACTION The method used in the experiment. |
Source type _diffrn_source.source | SYNCHROTRON The general class of the radiation source. |
Source details _diffrn_source.type | EMBL/DESY, HAMBURG The make, model or name of the source of radiation. |
Synchrotron site _diffrn_source.pdbx_synchrotron_site | EMBL/DESY, HAMBURG Synchrotron site. |
Temperature [K] _diffrn.ambient_temp | 277 The mean temperature in kelvins at which the intensities were |
Detector technology _diffrn_detector.detector | IMAGE PLATE The general class of the radiation detector. |
Collection date _diffrn_detector.pdbx_collection_date | 1990-05 The date of data collection. |
Software | |
Data reduction #1 _software.classification | MOSFLM The classification of the program according to its |
Data reduction #2 _software.classification | ROTAVATA/AGROVATA The classification of the program according to its |
Data scaling #1 _software.classification | CCP4 (AGROVATA The classification of the program according to its |
Data scaling #2 _software.classification | ROTAVATA The classification of the program according to its |
Phasing #1 _software.classification | TFFC The classification of the program according to its |
Phasing #2 _software.classification | X-PLOR (3.1) The classification of the program according to its |
Model building #1 _software.classification | TFFC The classification of the program according to its |
Model building #2 _software.classification | X-PLOR (3.1) The classification of the program according to its |
Refinement _software.classification | X-PLOR (3.1) The classification of the program according to its |
General information | |
Spacegroup name _symmetry.space_group_name_H-M | P 21 21 21 Hermann-Mauguin space-group symbol. Note that the |
Unit cell parameters _cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma} | 95.68 Unit-cell length a corresponding to the structure reported in 96.59 Unit-cell length b corresponding to the structure reported in 147.00 Unit-cell length c corresponding to the structure reported in 90.0 Unit-cell angle alpha of the reported structure in degrees. 90.0 Unit-cell angle beta of the reported structure in degrees. 90.0 Unit-cell angle gamma of the reported structure in degrees. |
Wavelength _diffrn_radiation_wavelength.wavelength | 0.96000 ÅThe radiation wavelength in angstroms. |
Data quality metrics | Overall |
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Low resolution limit [Å] _reflns.d_resolution_low | 20.000 The largest value in angstroms for the interplanar spacings |
High resolution limit [Å] _reflns.d_resolution_high | 3.100 The smallest value in angstroms for the interplanar spacings |
Rmerge _reflns.pdbx_Rmerge_I_obs | 0.065 The R value for merging intensities satisfying the observed |
Rmeas | - |
Rpim | - |
Total number of observations | - |
Total number unique _reflns.number_obs | 24209 The number of reflections in the REFLN list (not the DIFFRN_REFLN |
<I/σ(I)> _reflns.pdbx_netI_over_sigmaI | 10.50 The mean of the ratio of the intensities to their |
Completeness [%] _reflns.percent_possible_obs | 96.0 The percentage of geometrically possible reflections represented |
Multiplicity _reflns.pdbx_redundancy | 2.5 Overall redundancy for this data set. |
CC(1/2) | - |
Refinement | |
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PDB entry ID _entry.id | 1SGF |
Deposition date _pdbx_database_status.recvd_initial_deposition_date | 1997-08-08 |
Resolution _refine.ls_d_res_low _refine.ls_d_res_high | 8.0 - 3.150 Å |
Rwork/Rfree _refine.ls_R_factor_R_work _refine.ls_R_factor_R_free | 0.2460 / 0.2820 |
Structure solution method _refine.pdbx_method_to_determine_struct | MOLECULAR REPLACEMENT |
Starting model (for MR) _refine.pdbx_starting_model | BETA-NGF AND PORCINE PANCREATIC KALLIKREIN (1BET AND 2PKA) |