9OLC
Crystal structure of PPARg ligand-binding domain in complex with NCoR1 peptide and FTX-6746
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-03-21 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 1.12713 |
| Spacegroup name | P 1 |
| Unit cell lengths | 53.130, 70.330, 92.680 |
| Unit cell angles | 101.19, 106.58, 104.98 |
Refinement procedure
| Resolution | 48.046 - 2.830 |
| Rwork | 0.231 |
| R-free | 0.29830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.355 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.046 | 2.980 |
| High resolution limit [Å] | 2.830 | 2.830 |
| Number of reflections | 25524 | 3469 |
| <I/σ(I)> | 5.1 | |
| Completeness [%] | 90.0 | |
| Redundancy | 3.7 | |
| CC(1/2) | 0.995 | 0.889 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1 M MES pH 6.5, 0.1M Ammonium Sulfate, 24% PEG8000 |
