5G45
Ligand complex of RORg LBD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Detector | PILATUS |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 62.220, 62.220, 154.060 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 21.000 - 2.070 |
R-factor | 0.2106 |
Rwork | 0.208 |
R-free | 0.25550 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.010 |
RMSD bond angle | 1.010 |
Data reduction software | XDS |
Data scaling software | SCALA |
Refinement software | BUSTER (2.11.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 21.000 | 2.140 |
High resolution limit [Å] | 2.070 | 2.070 |
Rmerge | 0.260 | 1.500 |
Number of reflections | 19313 | |
<I/σ(I)> | 10.2 | 1.8 |
Completeness [%] | 100.0 | 100 |
Redundancy | 12.4 | 13.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |