Experiment | |
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Method _exptl.method | FIBER DIFFRACTION The method used in the experiment. |
Experimental protocol _diffrn_radiation.pdbx_diffrn_protocol | SINGLE WAVELENGTH SINGLE WAVELENGTH, LAUE, or MAD. |
Source type _diffrn_source.source | SYNCHROTRON The general class of the radiation source. |
Source details _diffrn_source.type | APS BEAMLINE 14-BM-C The make, model or name of the source of radiation. |
Synchrotron site _diffrn_source.pdbx_synchrotron_site | APS Synchrotron site. |
Beamline _diffrn_source.pdbx_synchrotron_beamline | 14-BM-C Synchrotron beamline. |
Detector technology _diffrn_detector.detector | CCD The general class of the radiation detector. |
Detector _diffrn_detector.type | ADSC QUANTUM 315 The make, model or name of the detector device used. |
Wavelength(s) [Å] _diffrn_source.pdbx_wavelength_list | 0.9002 Comma separated list of wavelengths or wavelength range. |
Software | |
Data collection _software.classification | ADSC (Quantum) The classification of the program according to its |
Data reduction #1 _software.classification | WCEN The classification of the program according to its |
Data reduction #2 _software.classification | RAD The classification of the program according to its |
Data reduction #3 _software.classification | CORR The classification of the program according to its |
Data scaling #1 _software.classification | WCEN The classification of the program according to its |
Data scaling #2 _software.classification | RAD The classification of the program according to its |
Data scaling #3 _software.classification | CORR The classification of the program according to its |
Phasing _software.classification | X-PLOR The classification of the program according to its |
Model building _software.classification | X-PLOR The classification of the program according to its |
Refinement _software.classification | X-PLOR The classification of the program according to its |
General information | |
Spacegroup name _symmetry.space_group_name_H-M | P 1 Hermann-Mauguin space-group symbol. Note that the |
Unit cell parameters _cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma} | 1.0 Unit-cell length a corresponding to the structure reported in 1.0 Unit-cell length b corresponding to the structure reported in 1.0 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 | 0.90020 ÅThe radiation wavelength in angstroms. |
Data quality metrics | Overall |
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Low resolution limit [Å] _reflns.d_resolution_low | 50.000 The largest value in angstroms for the interplanar spacings |
High resolution limit [Å] _reflns.d_resolution_high | 3.500 The smallest value in angstroms for the interplanar spacings |
Rmerge | - |
Rmeas | - |
Rpim | - |
Total number of observations | - |
Total number unique _reflns.number_obs | 3486 The number of reflections in the REFLN list (not the DIFFRN_REFLN |
<I/σ(I)> | - |
Completeness [%] _reflns.percent_possible_obs | 100.0 The percentage of geometrically possible reflections represented |
Multiplicity | - |
CC(1/2) | - |
Refinement | |
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PDB entry ID _entry.id | 3PDM |
Deposition date _pdbx_database_status.recvd_initial_deposition_date | 2010-10-22 |
Resolution _refine.ls_d_res_low _refine.ls_d_res_high | 50.0 - 3.500 Å |
R _refine.ls_R_factor_obs | 0.0960 |
Rwork _refine.ls_R_factor_R_work | 0.0960 WARNING: no Rfree given? |
Structure solution method _refine.pdbx_method_to_determine_struct | MOLECULAR REPLACEMENT |
Starting model (for MR) _refine.pdbx_starting_model | WARNING: no starting model (for MR) given |