6OPH
phosphorylated ERK2 with GDC-0994
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2012-03-28 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 42.070, 76.930, 151.760 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.590 - 2.400 |
| R-factor | 0.19536 |
| Rwork | 0.193 |
| R-free | 0.24287 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2erk |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.616 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.530 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.069 | 0.294 |
| Rmeas | 0.319 | |
| Rpim | 0.121 | |
| Number of reflections | 17814 | 1835 |
| <I/σ(I)> | 7.8 | |
| Completeness [%] | 88.9 | 69.4 |
| Redundancy | 5.9 | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9 | 293 | 36% PEG3350, 100mM bicine pH 9.0 |
