8C09
Crystal structure of JAK2 JH2-I559F
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-07-13 |
Detector | DECTRIS EIGER2 XE 16M |
Wavelength(s) | 0.976250 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.869, 53.192, 99.453 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.860 - 1.900 |
R-factor | 0.223 |
Rwork | 0.221 |
R-free | 0.25690 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4fvr |
RMSD bond length | 0.004 |
RMSD bond angle | 0.526 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 53.192 | 2.010 |
High resolution limit [Å] | 1.900 | 1.900 |
Number of reflections | 39521 | 6409 |
<I/σ(I)> | 7.89 | 0.84 |
Completeness [%] | 100.0 | 99.9 |
Redundancy | 6.4 | 6.6 |
CC(1/2) | 0.997 | 0.432 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 0.1 M Tris pH 8.5, 26% PEG4000, 0.2 M Na-acetate |