9KEM
Crystal structure of BRD4-BD1 in complex with H2AK5acK9ac
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2023-01-02 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97851 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 57.968, 79.592, 65.141 |
| Unit cell angles | 90.00, 92.78, 90.00 |
Refinement procedure
| Resolution | 32.800 - 1.940 |
| Rwork | 0.212 |
| R-free | 0.25170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.246 |
| Data reduction software | DIALS |
| Data scaling software | DIALS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.800 | 1.990 |
| High resolution limit [Å] | 1.940 | 1.940 |
| Rmerge | 0.111 | |
| Rmeas | 0.780 | |
| Rpim | 0.464 | |
| Number of reflections | 43731 | 3080 |
| <I/σ(I)> | 7.2 | |
| Completeness [%] | 99.7 | |
| Redundancy | 6.1 | |
| CC(1/2) | 0.994 | 0.518 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 289.15 | Ammonium sulfate, Hepes,PEG3350 |
