2GHM
Mutated MAP kinase P38 (Mus Musculus) in complex with Inhbitor PG-895449
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-06-01 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 65.169, 74.855, 77.879 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.350 |
R-factor | 0.23195 |
Rwork | 0.227 |
R-free | 0.32321 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.021 |
RMSD bond angle | 1.769 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.380 |
High resolution limit [Å] | 2.300 | 4.950 | 2.300 |
Rmerge | 0.066 | 0.037 | 0.576 |
Number of reflections | 15751 | ||
<I/σ(I)> | 11.6 | ||
Completeness [%] | 89.7 | ||
Redundancy | 4.1 | 4.4 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 288 | 18% (w/v) PEG 1500 100mM MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 288K |