6S2K
Human Menin in complex with AJ21
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, DESY BEAMLINE P11 |
| Synchrotron site | PETRA III, DESY |
| Beamline | P11 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-04-02 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0 A |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 84.399, 101.310, 126.842 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.040 - 3.100 |
| R-factor | 0.21936 |
| Rwork | 0.215 |
| R-free | 0.29989 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.470 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | DIMPLE |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.040 | 3.460 |
| High resolution limit [Å] | 3.100 | 3.100 |
| Rmerge | 0.200 | |
| Rmeas | 0.270 | |
| Number of reflections | 19448 | 1567 |
| <I/σ(I)> | 1.96 | |
| Completeness [%] | 95.2 | 97.51 |
| Redundancy | 3.78 | |
| CC(1/2) | 0.970 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277 | 100mM Bis-Tris propane 200mM KSCN 20% PEG3350 |
