6XJK
JAK2 JH2 in complex with JAK067
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-03-30 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.043, 57.633, 61.175 |
| Unit cell angles | 90.00, 111.45, 90.00 |
Refinement procedure
| Resolution | 40.504 - 2.024 |
| R-factor | 0.229481521976 |
| Rwork | 0.227 |
| R-free | 0.27251 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5usz |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.812 |
| 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 | 2.050 |
| High resolution limit [Å] | 2.020 | 2.020 |
| Rmerge | 0.115 | 0.545 |
| Rmeas | 0.140 | |
| Rpim | 0.079 | 0.382 |
| Number of reflections | 18548 | 922 |
| <I/σ(I)> | 8.7 | 2.07 |
| Completeness [%] | 96.9 | 96.8 |
| Redundancy | 2.9 | 2.6 |
| CC(1/2) | 0.929 | 0.734 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 277.15 | 0.1M TRIS, PH 8.0 0.2M SODIUM ACETATE, 0.001 M TCEP, 12-24% PEG 4,000 |
