8CJ3
Urea-based foldamer inhibitor c3u_7 chimera in complex with ASF1 histone chaperone
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-06-03 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97857 |
Spacegroup name | P 64 |
Unit cell lengths | 133.906, 133.906, 63.429 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.610 - 3.000 |
R-factor | 0.2034 |
Rwork | 0.203 |
R-free | 0.21690 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.920 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.4) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.047 | 3.078 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.180 | |
Rmeas | 0.184 | |
Rpim | 0.041 | 0.661 |
Number of reflections | 10565 | 238 |
<I/σ(I)> | 17.083 | 1.132 |
Completeness [%] | 80.1 | 24.59 |
Redundancy | 20.42 | 21.88 |
CC(1/2) | 0.999 | 0.569 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 290.15 | 0.2 M potassium fluoride 20% (w/v) PEG 3350 |