8FXO
Bromodomain of CBP liganded with iCBP8
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 93 |
Detector technology | PIXEL |
Collection date | 2021-10-29 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.0000 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 90.540, 34.630, 40.440 |
Unit cell angles | 90.00, 93.25, 90.00 |
Refinement procedure
Resolution | 32.340 - 1.740 |
R-factor | 0.1786 |
Rwork | 0.176 |
R-free | 0.20490 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.042 |
Data reduction software | XDS (Feb 5, 2021) |
Data scaling software | XSCALE (Feb 5, 2021) |
Phasing software | PHENIX (1.20.1_4487) |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.340 | 1.790 |
High resolution limit [Å] | 1.740 | 1.740 |
Rmeas | 0.034 | 0.130 |
Number of reflections | 12730 | 842 |
<I/σ(I)> | 26.8 | 7.6 |
Completeness [%] | 97.4 | 88.9 |
Redundancy | 4.7 | 3.7 |
CC(1/2) | 0.999 | 0.992 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 292 | 0.2 M Sodium acetate trihydrate, 0.1 M TRIS hydrochloride pH 8.5, 30% w/v Polyethylene glycol 4000 |