7M4T
Menin bound to M-1121
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-04-17 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 1.12714 |
| Spacegroup name | I 41 |
| Unit cell lengths | 153.520, 153.520, 81.930 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.550 - 2.740 |
| R-factor | 0.203 |
| Rwork | 0.202 |
| R-free | 0.21500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6wnh |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.960 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.790 |
| High resolution limit [Å] | 2.740 | 7.430 | 2.740 |
| Rmerge | 0.081 | 0.034 | 0.704 |
| Rmeas | 0.090 | 0.037 | 0.784 |
| Rpim | 0.039 | 0.016 | 0.341 |
| Total number of observations | 134851 | ||
| Number of reflections | 24922 | 1308 | 1105 |
| <I/σ(I)> | 10.4 | ||
| Completeness [%] | 98.8 | 99.4 | 89.8 |
| Redundancy | 5.4 | 5.5 | 4.7 |
| CC(1/2) | 0.995 | 0.806 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 2.0 M NaCl, 90.9 M Bis-Tris pH 6.5, 0.182 M MgCl2, 10 mM Pr Acetate |
