5NHP
Human Erk2 with an Erk1/2 inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-06-16 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.791, 71.115, 61.032 |
| Unit cell angles | 90.00, 111.03, 90.00 |
Refinement procedure
| Resolution | 44.460 - 1.990 |
| R-factor | 0.199 |
| Rwork | 0.198 |
| R-free | 0.22100 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.930 |
| Data reduction software | autoPROC |
| Data scaling software | Aimless ((version 0.3.6)) |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.6) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.540 | 2.001 |
| High resolution limit [Å] | 1.990 | 1.994 |
| Rmerge | 0.078 | 0.688 |
| Number of reflections | 26082 | |
| <I/σ(I)> | 11.5 | 2.2 |
| Completeness [%] | 97.8 | 94.8 |
| Redundancy | 3.3 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 30% PegMME2K, 100mM HEPES pH 7.6, 200mM Ammonium sulfate |
