6FQO
Crystal structure of CREBBP bromodomain complexd with DT29
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 | 2017-09-21 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.999989 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 50.736, 43.664, 51.301 |
Unit cell angles | 90.00, 99.42, 90.00 |
Refinement procedure
Resolution | 38.912 - 1.350 |
R-factor | 0.1719 |
Rwork | 0.171 |
R-free | 0.19410 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3dwy |
RMSD bond length | 0.007 |
RMSD bond angle | 1.126 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.660 | 1.374 |
High resolution limit [Å] | 1.350 | 1.350 |
Rmerge | 0.033 | 0.452 |
Number of reflections | 48359 | 2388 |
<I/σ(I)> | 26.5 | |
Completeness [%] | 99.0 | 96.1 |
Redundancy | 6.6 | 5.8 |
CC(1/2) | 1.000 | 0.898 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | 0.15 M KSCN, 20% PEG3350, 10% EG |