8T55
Co-crystal structure of the WD-repeat domain of human WDR91 in complex with MR46654
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-04-15 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 76.696, 121.618, 132.027 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.780 - 2.200 |
| R-factor | 0.2455 |
| Rwork | 0.245 |
| R-free | 0.28777 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.270 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.240 |
| High resolution limit [Å] | 2.200 | 5.970 | 2.200 |
| Rmerge | 0.080 | 0.052 | 1.014 |
| Rmeas | 0.086 | 0.056 | 1.083 |
| Rpim | 0.032 | 0.020 | 0.375 |
| Total number of observations | 478836 | ||
| Number of reflections | 62021 | 3219 | 3075 |
| <I/σ(I)> | 6.2 | ||
| Completeness [%] | 97.9 | 94.2 | 98.4 |
| Redundancy | 7.7 | 7.2 | 8.2 |
| CC(1/2) | 0.998 | 0.999 | 0.826 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 291 | 12% (w/v) PEG3350, 0.2 M KCl, 0.1 M MES pH 6.5 |
