| Experiment | |
|---|---|
Method _exptl.method | X-RAY DIFFRACTION |
Experimental protocol _diffrn_radiation.pdbx_diffrn_protocol | SINGLE WAVELENGTH |
Source type _diffrn_source.source | SEALED TUBE |
Source details _diffrn_source.type | OTHER |
Temperature [K] _diffrn.ambient_temp | 293 |
Detector technology _diffrn_detector.detector | DIFFRACTOMETER |
Collection date _diffrn_detector.pdbx_collection_date | 1981-02-02 |
Detector _diffrn_detector.type | hilger and watts |
Wavelength(s) [Å] _diffrn_source.pdbx_wavelength_list | 1.5406 |
| Software | |
Data reduction _software.classification | MOSFLM |
Data scaling _software.classification | in-house |
Phasing _software.classification | in-house |
Refinement _software.classification | PHENIX (1.14_3247) |
| General information | |
Spacegroup name _symmetry.space_group_name_H-M | P 21 21 2 |
Unit cell parameters _cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma} | 72.2 111.1 51.1 90.0 90.0 90.0 |
Wavelength _diffrn_radiation_wavelength.wavelength | 1.54060 Å |
| Data quality metrics | Overall | OuterShell |
|---|---|---|
Low resolution limit [Å] _reflns.d_resolution_low _reflns_shell.d_res_low | 39.050 | 2.870 |
High resolution limit [Å] _reflns.d_resolution_high _reflns_shell.d_res_high | 2.260 | 2.260 |
Rmerge _reflns.pdbx_Rmerge_I_obs | 0.068 | - |
| Rmeas | - | - |
| Rpim | - | - |
| Total number of observations | - | - |
Total number unique _reflns.number_obs _reflns_shell.number_unique_obs | 16562 | 6730 |
<I/σ(I)> _reflns.pdbx_netI_over_sigmaI | 8.30 | - |
Completeness [%] _reflns.percent_possible_obs _reflns_shell.percent_possible_all | 83.5 | 67.8 |
Multiplicity _reflns.pdbx_redundancy | 5.0 | - |
| CC(1/2) | - | - |
| Refinement | |
|---|---|
PDB entry ID _entry.id | 6PRO |
Deposition date _pdbx_database_status.recvd_initial_deposition_date | 2019-07-10 |
Resolution _refine.ls_d_res_low _refine.ls_d_res_high | 39.0 - 2.263 Å |
Rwork/Rfree _refine.ls_R_factor_R_work _refine.ls_R_factor_R_free | 0.1538 / 0.1961 |
Structure solution method _refine.pdbx_method_to_determine_struct | MIR |