7LAZ
Crystal structure of the first bromodomain (BD1) of human BRD3 bound to ERK5-IN-1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-03-28 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.000 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 81.903, 81.903, 120.242 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.710 - 2.302 |
R-factor | 0.2028 |
Rwork | 0.200 |
R-free | 0.23970 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7lay |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.340 |
High resolution limit [Å] | 2.300 | 6.240 | 2.300 |
Rmerge | 0.111 | 0.046 | 0.805 |
Rmeas | 0.116 | 0.048 | 0.848 |
Rpim | 0.035 | 0.015 | 0.262 |
Total number of observations | 204933 | ||
Number of reflections | 18845 | 1079 | 937 |
<I/σ(I)> | 7.2 | ||
Completeness [%] | 100.0 | 99.8 | 100 |
Redundancy | 10.9 | 9.4 | 10.3 |
CC(1/2) | 0.999 | 0.837 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.1 M HEPES pH 7.5, 4.3 M Sodium chloride |