7QP4
Complex of a Gemini-cholesterol analogue with Retinoid-related Orphan Receptor gamma
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-09-25 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.979957 |
Spacegroup name | P 61 |
Unit cell lengths | 99.381, 99.381, 129.308 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 40.830 - 2.300 |
R-factor | 0.18 |
Rwork | 0.178 |
R-free | 0.23730 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3l0l |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX (1.17_3644) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.830 | 2.382 |
High resolution limit [Å] | 2.300 | 2.300 |
Number of reflections | 32145 | 3197 |
<I/σ(I)> | 8.18 | |
Completeness [%] | 99.2 | |
Redundancy | 9.7 | |
CC(1/2) | 0.970 | 0.124 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.8M NH4 acetate, 0.1M Hepes pH = 7.5 |