6EL6
Glucocorticoid Receptor in complex with compound 4
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 | CCD |
| Collection date | 2011-04-18 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.873 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 84.955, 84.955, 106.374 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 43.100 - 2.400 |
| R-factor | 0.252 |
| Rwork | 0.250 |
| R-free | 0.28300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4csj |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.020 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.11.7) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.100 | 2.460 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rpim | 0.108 | 0.539 |
| Number of reflections | 17764 | 1293 |
| <I/σ(I)> | 5.6 | 1.7 |
| Completeness [%] | 99.6 | 99.3 |
| Redundancy | 5.6 | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | 8-10% PEG8000, 10-19% Ethylene Glycol, 0.1 M HEPES pH 7.5 |
