6BBV
Crystal Structure of JAK2 in complex with compound 25
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 | 2016-10-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 |
| Unit cell lengths | 36.380, 45.690, 49.010 |
| Unit cell angles | 69.03, 72.95, 81.60 |
Refinement procedure
| Resolution | 44.000 - 1.800 |
| R-factor | 0.1776 |
| Rwork | 0.175 |
| R-free | 0.21460 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.000 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | BUSTER |
| Refinement software | BUSTER (2.11.6) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 146.000 |
| High resolution limit [Å] | 1.800 |
| Number of reflections | 28123 |
| <I/σ(I)> | 18.7 |
| Completeness [%] | 99.9 |
| Redundancy | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 28% PEG-3350, 0.1 M sodium acetate, 0.1M Hepes, pH 7.5 |
