5NZZ
Crystal structure of phosphorylated p38aMAPK in complex with TAB1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-09-25 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.928 |
| Spacegroup name | P 1 |
| Unit cell lengths | 66.879, 107.632, 144.204 |
| Unit cell angles | 89.26, 76.75, 84.28 |
Refinement procedure
| Resolution | 140.359 - 2.600 |
| R-factor | 0.2213 |
| Rwork | 0.219 |
| R-free | 0.27070 |
| Structure solution method | MIRAS |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.226 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 140.360 | 2.640 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.086 | 0.637 |
| Rpim | 0.084 | 0.637 |
| Number of reflections | 109491 | 5166 |
| <I/σ(I)> | 7.1 | 0.9 |
| Completeness [%] | 91.4 | 87 |
| Redundancy | 1.9 | 1.7 |
| CC(1/2) | 0.960 | 0.413 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 20% PEG3350, 0.1M magensium chloride, 0.1M magnesium sulphate, 0.1M Tris pH8.5 |
