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 |