5IGM
Crystal structure of the bromodomain of human BRD9 in complex with bromosporine (BSP)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-07-03 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 70.177, 125.677, 29.787 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.690 - 1.600 |
R-factor | 0.22248 |
Rwork | 0.220 |
R-free | 0.26581 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3hme 2grc 2nxb 2oo1 2oss 2ouo 2rfj 3dai 3d7c 3dwy |
RMSD bond length | 0.014 |
RMSD bond angle | 1.423 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.980 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.029 | 0.503 |
Number of reflections | 35807 | |
<I/σ(I)> | 28 | 3.9 |
Completeness [%] | 99.9 | 100 |
Redundancy | 6.4 | 6.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277 | 0.1 M bis tris pH 5.5, 0.2 M sodium chloride, 25% PEG3350 |