3G0W
Crystal structure of the rat androgen receptor ligand binding domain complex with an n-aryl-oxazolidin 2-imine inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 32-ID |
Synchrotron site | APS |
Beamline | 32-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-12-11 |
Detector | MAR |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 54.862, 65.739, 69.750 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.840 - 1.950 |
R-factor | 0.2014 |
Rwork | 0.200 |
R-free | 0.23820 |
Structure solution method | MR |
RMSD bond length | 0.005 |
RMSD bond angle | 0.806 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | BUSTER-TNT (2.5.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.020 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.085 | 0.452 |
Number of reflections | 18851 | |
<I/σ(I)> | 20.6 | 4.6 |
Completeness [%] | 99.4 | 100 |
Redundancy | 7.3 | 7.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.88M NA TARTRATE, 0.1M NA HEPES, PH 7.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K |