5LQF
CDK1/CyclinB1/CKS2 in complex with NU6102
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-04-22 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.989 |
Spacegroup name | P 1 |
Unit cell lengths | 65.040, 67.750, 85.060 |
Unit cell angles | 103.88, 90.89, 90.42 |
Refinement procedure
Resolution | 65.700 - 2.060 |
R-factor | 0.20037 |
Rwork | 0.198 |
R-free | 0.25385 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4yc3 |
RMSD bond length | 0.022 |
RMSD bond angle | 2.233 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.700 | 2.100 |
High resolution limit [Å] | 2.060 | 2.060 |
Rmerge | 0.092 | 1.160 |
Number of reflections | 84841 | |
<I/σ(I)> | 6.2 | |
Completeness [%] | 97.3 | 95.5 |
Redundancy | 2 | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.7 | 277 | 0.1M MES/IMIDAZOLE BUFFER (PH6.7), 6.5% MPD, 5% PEG4K, 10% PEG1K PROTEIN AT 10-12 MG/ML |