2EWP
Crystal structure of Estrogen Related Receptor-3 (ERR-gamma) ligand binding domaind with tamoxifen analog GSK5182
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Detector technology | CCD |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 106.876, 75.776, 185.092 |
| Unit cell angles | 90.00, 104.84, 90.00 |
Refinement procedure
| Resolution | 19.940 - 2.300 |
| R-factor | 0.18841 |
| Rwork | 0.187 |
| R-free | 0.24694 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | Unliganded ERRgamma structure |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.183 |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 19.940 |
| High resolution limit [Å] | 2.300 |
| Rmerge | 0.057 |
| Number of reflections | 55805 |
| Completeness [%] | 87.5 |
| Redundancy | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 0.2M sodium Citrate, 20% PEG3350, VAPOR DIFFUSION, HANGING DROP |
