| Experiment | |
|---|---|
Method _exptl.method | X-RAY DIFFRACTION |
Experimental protocol _diffrn_radiation.pdbx_diffrn_protocol | SINGLE WAVELENGTH |
Source type _diffrn_source.source | SYNCHROTRON |
Source details _diffrn_source.type | APS BEAMLINE 24-ID-C |
Synchrotron site _diffrn_source.pdbx_synchrotron_site | APS |
Beamline _diffrn_source.pdbx_synchrotron_beamline | 24-ID-C |
Temperature [K] _diffrn.ambient_temp | 100 |
Detector technology _diffrn_detector.detector | PIXEL |
Collection date _diffrn_detector.pdbx_collection_date | 2015-04-06 |
Detector _diffrn_detector.type | DECTRIS PILATUS 6M-F |
Wavelength(s) [Å] _diffrn_source.pdbx_wavelength_list | 0.9791 |
| Software | |
Data reduction _software.classification | HKL-2000 |
Data scaling _software.classification | SCALEPACK |
Phasing #1 _software.classification | PHASER |
Phasing #2 _software.classification | SHARP |
Refinement _software.classification | PHENIX (1.12_2829: ???) |
| General information | |
Spacegroup name _symmetry.space_group_name_H-M | P 1 21 1 |
Unit cell parameters _cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma} | 89.238 100.707 99.088 90.00 92.27 90.00 |
Wavelength _diffrn_radiation_wavelength.wavelength | 0.97910 Å |
| Data quality metrics | Overall |
|---|---|
Low resolution limit [Å] _reflns.d_resolution_low | 100.000 |
High resolution limit [Å] _reflns.d_resolution_high | 1.800 |
| Rmerge | - |
Rmeas _reflns.pdbx_Rrim_I_all | 0.012 |
Rpim _reflns.pdbx_Rpim_I_all | 0.006 |
| Total number of observations | - |
Total number unique _reflns.number_obs | 156962 |
<I/σ(I)> _reflns.pdbx_netI_over_sigmaI | 11.30 |
Completeness [%] _reflns.percent_possible_obs | 97.7 |
Multiplicity _reflns.pdbx_redundancy | 4.1 |
| CC(1/2) | - |
| Refinement | |
|---|---|
PDB entry ID _entry.id | 6B9R |
Deposition date _pdbx_database_status.recvd_initial_deposition_date | 2017-10-11 |
Resolution _refine.ls_d_res_low _refine.ls_d_res_high | 89.2 - 1.802 Å |
Rwork/Rfree _refine.ls_R_factor_R_work _refine.ls_R_factor_R_free | 0.1524 / 0.1887 |
Structure solution method _refine.pdbx_method_to_determine_struct | SIRAS |