7L9A
Crystal structure of BRDT bromodomain 2 in complex with CDD-1102
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-07-20 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 56.470, 56.470, 191.901 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.900 - 2.270 |
R-factor | 0.2365 |
Rwork | 0.235 |
R-free | 0.26540 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4uyg |
RMSD bond length | 0.005 |
RMSD bond angle | 0.827 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.900 | 2.350 |
High resolution limit [Å] | 2.270 | 2.270 |
Number of reflections | 17166 | 1680 |
<I/σ(I)> | 4.4 | |
Completeness [%] | 99.6 | |
Redundancy | 2 | |
CC(1/2) | 0.980 | 0.410 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 298 | 0.8 M succinic acid |