9IJU
Sertraline enhances the deubiquitinase activity of USP7 by binding to its switching loop region
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL02U1 |
| Synchrotron site | SSRF |
| Beamline | BL02U1 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2021-07-02 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 100.640, 84.860, 106.780 |
| Unit cell angles | 90.00, 90.21, 90.00 |
Refinement procedure
| Resolution | 20.581 - 2.460 |
| R-factor | 0.2208 |
| Rwork | 0.218 |
| R-free | 0.27020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1nb8 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.990 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.16_3549: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.581 | 2.548 |
| High resolution limit [Å] | 2.460 | 2.460 |
| Rmerge | 0.045 | 0.632 |
| Number of reflections | 65312 | 6466 |
| <I/σ(I)> | 12.84 | |
| Completeness [%] | 99.5 | |
| Redundancy | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1 M Bis-tris pH 6.5, 0.2 M MgCl2, 25% PEG3350 |
