8QJT
BRM (SMARCA2) Bromodomain in complex with ligand 10
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-12-13 |
Detector | DECTRIS EIGER2 XE 16M |
Wavelength(s) | 0.97625 |
Spacegroup name | P 31 |
Unit cell lengths | 63.750, 63.750, 88.510 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 55.210 - 2.568 |
R-factor | 0.2054 |
Rwork | 0.203 |
R-free | 0.26300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.940 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.8) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 55.210 | 2.610 |
High resolution limit [Å] | 2.570 | 2.570 |
Rmerge | 0.144 | 0.932 |
Number of reflections | 12685 | 646 |
<I/σ(I)> | 9.5 | 2.1 |
Completeness [%] | 98.9 | 100 |
Redundancy | 5.4 | 5.4 |
CC(1/2) | 0.996 | 0.829 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 20% PEG 6K, 6% ethylene glycol, 10 mM ZnCl2 |