3QYW
Crystal structure of ERK2 in complex with an inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-10-04 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.933 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 49.067, 70.254, 60.168 |
| Unit cell angles | 90.00, 108.72, 90.00 |
Refinement procedure
| Resolution | 36.981 - 1.500 |
| R-factor | 0.1502 |
| Rwork | 0.148 |
| R-free | 0.18770 |
| Structure solution method | Isomorphous replacement |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.123 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.749 | 1.580 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Number of reflections | 84729 | |
| Completeness [%] | 91.7 | 84.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291.15 | 26% PEG MME 2000, 0.1M MES, 0.1M ammonium sulfate, 0.02M beta-mercaptoethanol, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291.15K |
