2Y8O
Crystal structure of human p38alpha complexed with a MAPK docking peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-11-25 |
Detector | MARRESEARCH |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 81.920, 81.920, 122.590 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.380 - 1.950 |
R-factor | 0.177 |
Rwork | 0.176 |
R-free | 0.20900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gc7 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.145 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 70.950 | 2.000 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.080 | 0.800 |
Number of reflections | 35294 | |
<I/σ(I)> | 13.18 | 2.04 |
Completeness [%] | 100.0 | 100 |
Redundancy | 4.86 | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 22% PEG3350 100MM HEPES 7.5 |