9WKW
Wild-type Menin complexed with DS-1594
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-12-06 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.953739 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.786, 78.646, 92.615 |
| Unit cell angles | 90.00, 101.51, 90.00 |
Refinement procedure
| Resolution | 48.120 - 1.630 |
| R-factor | 0.15491 |
| Rwork | 0.154 |
| R-free | 0.17634 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7uj4 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.802 |
| Data reduction software | XDS |
| Data scaling software | pointless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.120 | 1.650 |
| High resolution limit [Å] | 1.626 | 1.626 |
| Number of reflections | 120522 | 5440 |
| <I/σ(I)> | 16 | 4.5 |
| Completeness [%] | 97.9 | 89.4 |
| Redundancy | 7 | 3.4 |
| CC(1/2) | 0.998 | 0.930 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 294 | 22%(w/v) PEG3350, 0.2M MAGNESIUM NITRATE, 0.1 M HEPES PH=7.8, 20%(v/v) ETHYLENE GLYCOL, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 294K |
