9AXH
Crystal structure of KSR1/MEK1 complex heterotetramer with NST-628
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-07-06 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.97629 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 249.870, 67.080, 74.400 |
| Unit cell angles | 90.00, 90.25, 90.00 |
Refinement procedure
| Resolution | 52.240 - 2.810 |
| R-factor | 0.2057 |
| Rwork | 0.203 |
| R-free | 0.25330 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.627 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 52.240 | 2.910 |
| High resolution limit [Å] | 2.810 | 2.810 |
| Rmerge | 0.051 | 0.670 |
| Number of reflections | 30392 | 2553 |
| <I/σ(I)> | 18 | |
| Completeness [%] | 99.9 | |
| Redundancy | 6.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 0.1M SPG buffer pH 7.0, 25% w/v PEG 1500 |
