8QRD
OleP in complex with testosterone in high salt crystallization conditions
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ELETTRA BEAMLINE 11.2C |
Synchrotron site | ELETTRA |
Beamline | 11.2C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-01-28 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.0002 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 248.195, 109.738, 160.130 |
Unit cell angles | 90.00, 129.41, 90.00 |
Refinement procedure
Resolution | 45.750 - 2.300 |
R-factor | 0.16762 |
Rwork | 0.165 |
R-free | 0.21226 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.692 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 66.070 | 2.340 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.108 | 1.785 |
Number of reflections | 147079 | 7268 |
<I/σ(I)> | 13.3 | |
Completeness [%] | 99.9 | |
Redundancy | 6.7 | |
CC(1/2) | 0.999 | 0.509 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 295 | 4.4 M sodium formate |