5HEN
Crystal structure of the N-terminus R100L bromodomain mutant of human BRD2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-04-25 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 115.381, 55.757, 68.451 |
| Unit cell angles | 90.00, 94.76, 90.00 |
Refinement procedure
| Resolution | 29.440 - 1.790 |
| R-factor | 0.18293 |
| Rwork | 0.181 |
| R-free | 0.22267 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4alh |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.902 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.440 | 1.830 |
| High resolution limit [Å] | 1.790 | 1.790 |
| Rmerge | 0.063 | 0.790 |
| Number of reflections | 40528 | |
| <I/σ(I)> | 14.2 | 2 |
| Completeness [%] | 99.5 | 93.5 |
| Redundancy | 5.9 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277 | 1 M ammonium sulfate, 0.1 M MES pH 6.3 |
