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 |
