8EX0
Crystal structure of JAK2 JH2 (pseudokinase domain) in complex with CDK2-IV
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-08-18 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.9794 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 43.986, 57.576, 61.185 |
Unit cell angles | 90.00, 110.38, 90.00 |
Refinement procedure
Resolution | 29.030 - 1.850 |
R-factor | 0.1792 |
Rwork | 0.175 |
R-free | 0.22760 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.011 |
RMSD bond angle | 1.048 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.030 | 1.880 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.062 | 0.598 |
Number of reflections | 24853 | 1229 |
<I/σ(I)> | 13.6 | |
Completeness [%] | 99.9 | 100 |
Redundancy | 3.8 | 3.7 |
CC(1/2) | 0.858 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9.5 | 277 | CHES, PEG 3000 |