5EPL
Crystal Structure of chromodomain of CBX4 in complex with inhibitor UNC3866
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-06-13 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9786036 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 65.178, 65.178, 133.057 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 44.000 - 1.810 |
R-factor | 0.187 |
Rwork | 0.183 |
R-free | 0.21600 |
RMSD bond length | 0.018 |
RMSD bond angle | 1.753 |
Data scaling software | Aimless (0.5.1) |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.350 | 1.840 |
High resolution limit [Å] | 1.810 | 1.810 |
Rmerge | 0.064 | 0.664 |
Number of reflections | 16048 | |
<I/σ(I)> | 37.4 | 5.4 |
Completeness [%] | 99.9 | 98.7 |
Redundancy | 20.4 | 19.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 30% PEG3350, 0.2M sodium chloride, 0.1 M sodium cacodylate |