6EL9
Glucocorticoid Receptor in complex with AZD9567
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-02-03 |
Detector | DECTRIS PILATUS 12M |
Wavelength(s) | 0.976 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 84.523, 84.523, 105.718 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 60.180 - 2.190 |
R-factor | 0.195 |
Rwork | 0.194 |
R-free | 0.22400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4csj |
RMSD bond length | 0.010 |
RMSD bond angle | 1.020 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.7) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 105.720 | 2.310 |
High resolution limit [Å] | 2.190 | 2.190 |
Rpim | 0.032 | 0.358 |
Number of reflections | 22910 | |
<I/σ(I)> | 17.4 | 2.6 |
Completeness [%] | 100.0 | |
Redundancy | 9.7 |
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 |