3GCP
Human P38 MAP Kinase in Complex with SB203580
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 90 |
Detector technology | CCD |
Collection date | 2008-05-26 |
Detector | MARRESEARCH |
Wavelength(s) | 1.01630 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 68.890, 69.870, 74.510 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.000 - 2.250 |
R-factor | 0.201 |
Rwork | 0.197 |
R-free | 0.27600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ewa |
RMSD bond length | 0.016 |
RMSD bond angle | 1.662 |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.350 |
High resolution limit [Å] | 2.250 | 2.250 |
Rmerge | 0.046 | 0.232 |
Number of reflections | 17526 | 2035 |
<I/σ(I)> | 25.39 | 5.3 |
Completeness [%] | 99.4 | 96.6 |
Redundancy | 4.49 | 2.49 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.9 | 293 | 100 mM MES, 20-30% PEG4000, 50 mM n-BOG, pH 5.9, VAPOR DIFFUSION, HANGING DROP, temperature 293K |