4LOO
Structural basis of autoactivation of p38 alpha induced by TAB1 (Monoclinic crystal form)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-04-21 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.9763 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 43.340, 73.580, 59.190 |
Unit cell angles | 90.00, 91.15, 90.00 |
Refinement procedure
Resolution | 46.110 - 1.950 |
R-factor | 0.20033 |
Rwork | 0.198 |
R-free | 0.25024 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3que |
RMSD bond length | 0.016 |
RMSD bond angle | 1.596 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 59.180 | 2.060 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.061 | 0.758 |
Number of reflections | 27019 | |
<I/σ(I)> | 12.3 | 2 |
Completeness [%] | 99.4 | 98.7 |
Redundancy | 4.1 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277.15 | 25% medium-molecular weight PEG Smears, 0.1 M MES, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 277.15K |