5Z1R
Crystal Structure Analysis of the BRD4
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 | 2015-04-30 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97852 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 35.570, 47.200, 78.500 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.450 - 1.620 |
R-factor | 0.176 |
Rwork | 0.175 |
R-free | 0.19310 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.774 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless (0.5.8) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 78.500 | 1.640 |
High resolution limit [Å] | 1.620 | 1.620 |
Rmerge | 0.086 | 0.251 |
Rmeas | 0.090 | 0.263 |
Rpim | 0.026 | 0.074 |
Number of reflections | 16098 | 845 |
<I/σ(I)> | 18.3 | |
Completeness [%] | 91.6 | 99.9 |
Redundancy | 11.8 | 12.2 |
CC(1/2) | 0.997 | 0.990 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 20% PEG 3350, 0.1M HEPES, 10% EtGhly, PH8.2 |