6SQE
Crystal structure of CREBBP bromodomain complexed with KD341
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 | 2019-04-04 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 86.790, 36.440, 42.230 |
| Unit cell angles | 90.00, 102.75, 90.00 |
Refinement procedure
| Resolution | 41.188 - 1.506 |
| Rwork | 0.161 |
| R-free | 0.19060 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5mme |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.300 | 1.600 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Number of reflections | 19998 | 3159 |
| <I/σ(I)> | 30.93 | |
| Completeness [%] | 97.1 | 96.3 |
| Redundancy | 3.42 | |
| CC(1/2) | 1.000 | 0.991 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277.15 | 0.2M MgCl2, 25% PEG 3350, 0.1M BisTris pH 5.5 |
