1S9P
crystal structure of the ligand-binding domain of the estrogen-related receptor gamma in complex with diethylstilbestrol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-10-07 |
| Detector | ADSC QUANTUM 4 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 71.999, 77.460, 95.773 |
| Unit cell angles | 90.00, 97.55, 90.00 |
Refinement procedure
| Resolution | 29.300 - 2.130 |
| R-factor | 0.226 |
| Rwork | 0.226 |
| R-free | 0.25100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1kv6 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.140 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.000 | 2.210 |
| High resolution limit [Å] | 2.130 | 2.130 |
| Number of reflections | 57942 | |
| <I/σ(I)> | 46.6 | 9.7 |
| Completeness [%] | 99.0 | 99.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 297 | PEG3350, NaOAc, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 297K, pH 8.00 |
