5USZ
JAK2 JH2 in complex with JNJ-7706621
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-03-04 |
Detector | DECTRIS PILATUS 200K |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.716, 57.533, 60.769 |
Unit cell angles | 90.00, 110.41, 90.00 |
Refinement procedure
Resolution | 41.910 - 2.103 |
R-factor | 0.1744 |
Rwork | 0.172 |
R-free | 0.22350 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4fvp |
RMSD bond length | 0.002 |
RMSD bond angle | 0.580 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.910 | |
High resolution limit [Å] | 2.100 | 2.100 |
Number of reflections | 16371 | |
<I/σ(I)> | 9.6 | |
Completeness [%] | 96.7 | |
Redundancy | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | 0.1M Tris, pH 8.0 0.2M Sodium acetate 12-20% PEG 4,000 |