6DNE
Crystal structure of human Bromodomain-containing protein 4 (BRD4) bromodomain with MS660
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL14-1 |
Synchrotron site | SSRL |
Beamline | BL14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-03-12 |
Detector | RAYONIX MX-325 |
Wavelength(s) | 1.0875 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 87.540, 87.540, 172.300 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 42.423 - 2.958 |
R-factor | 0.245 |
Rwork | 0.243 |
R-free | 0.28530 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3zyu |
RMSD bond length | 0.003 |
RMSD bond angle | 1.209 |
Data reduction software | HKL-2000 |
Data scaling software | SCALA |
Phasing software | BALBES |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.010 |
High resolution limit [Å] | 2.958 | 2.958 |
Number of reflections | 8745 | |
<I/σ(I)> | 16.6 | |
Completeness [%] | 99.8 | 98.5 |
Redundancy | 9.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 30% PEG 4000 0.1M TrisHCl pH8.5 0.2M Mg Chloride |