Experiment | |
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Method _exptl.method | X-RAY DIFFRACTION The method used in the experiment. |
Source type _diffrn_source.source | ROTATING ANODE The general class of the radiation source. |
Source details _diffrn_source.type | ELLIOTT GX-21 The make, model or name of the source of radiation. |
Detector technology _diffrn_detector.detector | AREA DETECTOR The general class of the radiation detector. |
Detector _diffrn_detector.type | SIEMENS-NICOLET The make, model or name of the detector device used. |
Software | |
Refinement #1 _software.classification | PROLSQ (MODIFIED BY G.J.QUIGLEY) The classification of the program according to its |
Refinement #2 _software.classification | MODIFIED (BY G.J.QUIGLEY) 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} | 25.130 Unit-cell length a corresponding to the structure reported in 45.649 Unit-cell length b corresponding to the structure reported in 47.554 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 | NA |
Data quality metrics | Overall |
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Low resolution limit [Å] _reflns.d_resolution_low | 10.000 The largest value in angstroms for the interplanar spacings |
High resolution limit [Å] _reflns.d_resolution_high | 2.000 The smallest value in angstroms for the interplanar spacings |
Rmerge | - |
Rmeas | - |
Rpim | - |
Total number of observations | - |
Total number unique _reflns.number_obs | 3576 The number of reflections in the REFLN list (not the DIFFRN_REFLN |
<I/σ(I)> | - |
Completeness [%] | - |
Multiplicity | - |
CC(1/2) | - |
Refinement | |
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PDB entry ID _entry.id | 168D |
Deposition date _pdbx_database_status.recvd_initial_deposition_date | 1994-04-08 |
Resolution _refine.ls_d_res_low _refine.ls_d_res_high | 10.0 - 2.000 Å |
R _refine.ls_R_factor_obs | 0.1930 WARNING: neither Rwork nor Rfree given |