6V6A
Inhibitory scaffolding of the ancient MAPK, ERK7
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-003 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-05-08 |
| Detector | RIGAKU HyPix-6000HE |
| Wavelength(s) | 1.5406 |
| Spacegroup name | P 1 |
| Unit cell lengths | 50.890, 52.938, 67.800 |
| Unit cell angles | 82.55, 84.58, 81.35 |
Refinement procedure
| Resolution | 29.890 - 2.100 |
| R-factor | 0.1607 |
| Rwork | 0.158 |
| R-free | 0.21180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3oz6 |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.610 |
| Data reduction software | CrysalisPro (40.37a) |
| Data scaling software | CrysalisPro (40.37a) |
| Phasing software | PHASER (2.5.5) |
| Refinement software | PHENIX (1.17.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.890 | 2.175 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.053 | 0.198 |
| Rmeas | 0.067 | 0.274 |
| Rpim | 0.039 | 0.190 |
| Number of reflections | 39049 | 3083 |
| <I/σ(I)> | 15.17 | 3.48 |
| Completeness [%] | 96.7 | 76.39 |
| Redundancy | 2.4 | 1.3 |
| CC(1/2) | 0.997 | 0.894 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 292 | 20% PEG 3350, 0.15 M DL-Malic acid |
