7SZW
JAK2 JH2 in complex with JAK249
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-08-20 |
Detector | DECTRIS PILATUS 200K |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.710, 57.366, 60.749 |
Unit cell angles | 90.00, 110.83, 90.00 |
Refinement procedure
Resolution | 41.412 - 1.906 |
R-factor | 0.194572441083 |
Rwork | 0.193 |
R-free | 0.22575 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5usz |
RMSD bond length | 0.007 |
RMSD bond angle | 0.810 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.950 |
High resolution limit [Å] | 1.906 | 1.906 |
Rmerge | 0.105 | 0.696 |
Rmeas | 0.775 | |
Rpim | 0.333 | |
Number of reflections | 22230 | 1081 |
<I/σ(I)> | 19.93 | 2.347 |
Completeness [%] | 99.8 | |
Redundancy | 7.7 | |
CC(1/2) | 0.970 | 0.843 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277.15 | 0.1M TRIS, PH 8.0 0.2M SODIUM ACETATE, 0.001 M TCEP, 12-24% PEG 4,000 |