7OFK
Ligand complex of RORg LBD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-09-24 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.976 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 61.050, 61.050, 159.780 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.510 - 1.610 |
R-factor | 0.2015 |
Rwork | 0.200 |
R-free | 0.22950 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3lol |
RMSD bond length | 0.008 |
RMSD bond angle | 0.870 |
Data reduction software | autoPROC |
Data scaling software | Aimless |
Phasing software | BUSTER |
Refinement software | BUSTER (2.11.8) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.510 | 1.670 |
High resolution limit [Å] | 1.610 | 1.610 |
Number of reflections | 40191 | 3855 |
<I/σ(I)> | 16.4 | |
Completeness [%] | 100.0 | |
Redundancy | 12.6 | |
CC(1/2) | 0.999 | 0.552 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 295 | soaking |