5IZ0
RORgamma in complex with agonist BIO592 and Coactivator EBI96
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 31-ID |
| Synchrotron site | APS |
| Beamline | 31-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-06-20 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 85.672, 68.111, 96.056 |
| Unit cell angles | 90.00, 109.90, 90.00 |
Refinement procedure
| Resolution | 80.558 - 2.635 |
| R-factor | 0.2023 |
| Rwork | 0.199 |
| R-free | 0.25530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3LOL |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.655 |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 80.558 |
| High resolution limit [Å] | 2.635 |
| Number of reflections | 31077 |
| <I/σ(I)> | 9.9 |
| Completeness [%] | 99.6 |
| Redundancy | 2.63 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | 0.1M HEPES pH 8.0 0.2M NaCl 25% PEG3350 |
