8FVS
Bromodomain of CBP liganded with CCS1477int
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 93 |
Detector technology | CCD |
Collection date | 2021-04-11 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 35.070, 79.190, 46.130 |
Unit cell angles | 90.00, 93.85, 90.00 |
Refinement procedure
Resolution | 39.790 - 1.750 |
R-factor | 0.1538 |
Rwork | 0.152 |
R-free | 0.18090 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.113 |
Data reduction software | XDS (Jan 10, 2022) |
Data scaling software | XSCALE (Jan 10, 2022) |
Phasing software | PHENIX (1.20.1-4487) |
Refinement software | PHENIX (1.20.1-4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.790 | 1.800 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmeas | 0.244 | 0.574 |
Number of reflections | 25279 | 1817 |
<I/σ(I)> | 16.2 | 6.1 |
Completeness [%] | 99.6 | 98.8 |
Redundancy | 7.3 | |
CC(1/2) | 0.994 | 0.931 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 291 | 0.2M Magnesium chloride hexahydrate, 0.1 M Tris 8.5, 25 % w/v Polyethylene glycol 3,350 |