8PM3
Crystal structure of MAP2K6 with a covalent compound GCL94
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-05-01 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.00003 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 66.328, 97.529, 104.550 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.620 - 2.000 |
| R-factor | 0.19771 |
| Rwork | 0.196 |
| R-free | 0.23615 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.509 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0411) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.620 | 2.040 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Number of reflections | 88885 | 4551 |
| <I/σ(I)> | 13.4 | 2.6 |
| Completeness [%] | 98.9 | 99.4 |
| Redundancy | 5.8 | |
| CC(1/2) | 0.990 | 0.880 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293.15 | 0.05M magnesium chloride -- 30% PEG500MME -- 0.1M HEPES pH 7.5 |
