5HEL
Crystal structure of the N-terminus Y153H 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 | P 43 21 2 |
| Unit cell lengths | 47.743, 47.743, 125.795 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.750 - 1.450 |
| R-factor | 0.19181 |
| Rwork | 0.191 |
| R-free | 0.20899 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4alh |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.479 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.750 | 1.530 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.044 | 0.336 |
| Number of reflections | 26847 | |
| <I/σ(I)> | 34.2 | 9.8 |
| Completeness [%] | 99.9 | 99.2 |
| Redundancy | 13.7 | 12.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277 | 20% PEG smear high, 0.1 M Mes pH 6.5 |
