| Experiment | |
|---|---|
Method _exptl.method | X-RAY DIFFRACTION |
Experimental protocol _diffrn_radiation.pdbx_diffrn_protocol | LAUE |
Source type _diffrn_source.source | SYNCHROTRON |
Source details _diffrn_source.type | CHESS |
Synchrotron site _diffrn_source.pdbx_synchrotron_site | CHESS |
Temperature [K] _diffrn.ambient_temp | 279.0 |
Detector technology _diffrn_detector.detector | FILM |
Collection date _diffrn_detector.pdbx_collection_date | 1990-11-15 |
Detector _diffrn_detector.type | KODAK DEF5 |
Wavelength(s) [Å] _diffrn_source.pdbx_wavelength_list | 0.2-2.5 |
| Software | |
Data reduction _software.classification | LEAP |
Data scaling _software.classification | LEAP |
Phasing #1 _software.classification | CCP4 |
Phasing #2 _software.classification | X-PLOR |
Refinement _software.classification | X-PLOR (3.1) |
| General information | |
Spacegroup name _symmetry.space_group_name_H-M | P 21 21 21 |
Unit cell parameters _cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma} | 107.4 76.8 51.4 90.0 90.0 90.0 |
Wavelength _diffrn_radiation_wavelength.wavelength | 0.200002.50000 Å |
| Data quality metrics | Overall |
|---|---|
Low resolution limit [Å] _reflns.d_resolution_low | 8.000 |
High resolution limit [Å] _reflns.d_resolution_high | 2.200 |
Rmerge _reflns.pdbx_Rmerge_I_obs | 0.094 |
| Rmeas | - |
| Rpim | - |
| Total number of observations | - |
Total number unique _reflns.number_obs | 9089 |
<I/σ(I)> _reflns.pdbx_netI_over_sigmaI | 37.50 |
Completeness [%] _reflns.percent_possible_obs | 42.0 |
Multiplicity _reflns.pdbx_redundancy | 7.7 |
| CC(1/2) | - |
| Refinement | |
|---|---|
PDB entry ID _entry.id | 1EBE |
Deposition date _pdbx_database_status.recvd_initial_deposition_date | 2001-07-25 |
Resolution _refine.ls_d_res_low _refine.ls_d_res_high | 8.0 - 2.200 Å |
R _refine.ls_R_factor_obs | 0.1440 |
Rwork _refine.ls_R_factor_R_work | 0.1440 WARNING: no Rfree given? |
Structure solution method _refine.pdbx_method_to_determine_struct | FOURIER SYNTHESIS |
Starting model _refine.pdbx_starting_model | 2CYP |