3R30
MK2 kinase bound to Compound 2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2006-08-14 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54 |
| Spacegroup name | F 41 3 2 |
| Unit cell lengths | 253.297, 253.297, 253.297 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.250 - 3.200 |
| R-factor | 0.284 |
| Rwork | 0.279 |
| R-free | 0.33200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.537 |
| Data reduction software | CrystalClear |
| Data scaling software | CrystalClear |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.850 | 3.310 |
| High resolution limit [Å] | 3.200 | 3.200 |
| Rmerge | 0.228 | 0.756 |
| Number of reflections | 20639 | |
| <I/σ(I)> | 2.4 | |
| Completeness [%] | 94.1 | 94.7 |
| Redundancy | 8.43 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 1.8 M Sodium Malonate, pH 5.0, vapor diffusion, hanging drop, temperature 293K |
