3MVM
P38 Alpha Map Kinase complexed with pyrrolotriazine inhibitor 7V
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-BM |
| Synchrotron site | APS |
| Beamline | 17-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-08-11 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 67.310, 71.340, 72.530 |
| Unit cell angles | 90.00, 90.47, 90.00 |
Refinement procedure
| Resolution | 24.480 - 2.000 |
| R-factor | 0.199 |
| Rwork | 0.197 |
| R-free | 0.23800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.090 |
| Data reduction software | DENZO (/ HKL2000) |
| Data scaling software | SCALEPACK |
| Refinement software | BUSTER (2.9.4) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.066 | 0.354 |
| Number of reflections | 46382 | |
| <I/σ(I)> | 21.6 | 3.8 |
| Completeness [%] | 99.6 | 97.6 |
| Redundancy | 6.2 | 4.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
