9IML
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] | 100 |
| 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 | 101.570, 84.970, 106.990 |
| Unit cell angles | 90.00, 90.11, 90.00 |
Refinement procedure
| Resolution | 33.670 - 2.780 |
| R-factor | 0.2239 |
| Rwork | 0.221 |
| R-free | 0.28030 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1nbf |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.16_3549: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.670 | 2.879 |
| High resolution limit [Å] | 2.780 | 2.780 |
| Rmerge | 0.038 | 0.381 |
| Number of reflections | 45859 | 4436 |
| <I/σ(I)> | 16.67 | |
| Completeness [%] | 99.2 | |
| 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 |
