7XHK
High-resolution X-ray cocrystal structure of USP7 in complex with LX04-46
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | Cu FINE FOCUS |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-01-19 |
| Detector | RIGAKU HyPix-6000HE |
| Wavelength(s) | 1.5418 |
| Spacegroup name | I 1 2 1 |
| Unit cell lengths | 75.961, 70.856, 77.584 |
| Unit cell angles | 90.00, 95.36, 90.00 |
Refinement procedure
| Resolution | 12.870 - 2.300 |
| R-factor | 0.2223 |
| Rwork | 0.220 |
| R-free | 0.26400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6m1k |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.1_3865) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 12.870 | 12.870 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.093 | 0.093 |
| Number of reflections | 17003 | 17003 |
| <I/σ(I)> | 19.32 | |
| Completeness [%] | 99.4 | |
| Redundancy | 19.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 289 | 20mg/ml Crystal, 100mM Tris,20% PEG 1000, PH 7.0 |
