5EP7
Crystal structure of the bromodomain of human CREBBP in complex with UN32
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-04-27 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1.00002 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 24.353, 45.359, 104.230 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.591 - 1.198 |
| R-factor | 0.1665 |
| Rwork | 0.166 |
| R-free | 0.17620 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.158 |
| Data reduction software | XDS |
| Data scaling software | SCALA (3.3.22) |
| Phasing software | PHASER (2.5.7) |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 52.115 | 45.359 | 1.260 |
| High resolution limit [Å] | 1.198 | 3.790 | 1.198 |
| Rmerge | 0.027 | 0.154 | |
| Rmeas | 0.038 | ||
| Rpim | 0.011 | 0.008 | 0.048 |
| Total number of observations | 434398 | 15588 | 55909 |
| Number of reflections | 37308 | ||
| <I/σ(I)> | 37.4 | 78.9 | 13.3 |
| Completeness [%] | 99.7 | 99.8 | 98.1 |
| Redundancy | 11.6 | 11.5 | 10.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 0.2M KSCN, 20% PEG3350, 10% EtGly, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
