6FQU
Crystal structure of CREBBP bromodomain complexd with DR09
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-10-15 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.000041 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 35.258, 49.762, 80.576 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.339 - 1.430 |
R-factor | 0.1674 |
Rwork | 0.166 |
R-free | 0.18960 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3dwy |
RMSD bond length | 0.005 |
RMSD bond angle | 0.842 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.340 | 1.450 |
High resolution limit [Å] | 1.430 | 1.430 |
Rmerge | 0.060 | 0.469 |
Number of reflections | 26946 | 1291 |
<I/σ(I)> | 24.3 | 4.2 |
Completeness [%] | 99.9 | 99.4 |
Redundancy | 12.5 | 8 |
CC(1/2) | 0.999 | 0.864 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | 0.15 M KSCN, 20% PEG3350, 10% EG |