5DFD
Crystal structure of BRD2(BD2) W370F mutant with ligand 28 bound
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 | 2012-12-18 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 32.122, 52.439, 71.970 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.670 - 1.500 |
| R-factor | 0.16056 |
| Rwork | 0.160 |
| R-free | 0.17548 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5dfb |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.448 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.670 | 1.580 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.039 | 0.124 |
| Number of reflections | 20171 | |
| <I/σ(I)> | 33.3 | 14.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 8.5 | 8.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293.15 | 0.1M Hepes pH 7, 0.2M Imidiazole, 41% PEG 400 |
