5WFJ
THE JAK3 KINASE DOMAIN IN COMPLEX WITH A COVALENT INHIBITOR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2010-08-20 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 47.340, 75.690, 88.950 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.790 - 2.480 |
| R-factor | 0.205 |
| Rwork | 0.200 |
| R-free | 0.25500 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.020 |
| Data reduction software | HKL-2000 ((DENZO)) |
| Data scaling software | HKL-2000 ((SCALEPACK)) |
| Refinement software | BUSTER (2.11.7) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.790 | 2.610 |
| High resolution limit [Å] | 2.480 | 2.480 |
| Rmerge | 0.105 | 0.625 |
| Number of reflections | 11227 | |
| <I/σ(I)> | 2.3 | 2.3 |
| Completeness [%] | 95.1 | 100 |
| Redundancy | 6.1 | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293 |
