9VGE
SIRT2 demyristoylation intermediate I structure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-10-29 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97861 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 37.059, 77.646, 55.955 |
| Unit cell angles | 90.00, 97.99, 90.00 |
Refinement procedure
| Resolution | 55.474 - 2.560 |
| Rwork | 0.203 |
| R-free | 0.28190 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4x3o |
| RMSD bond length | 0.027 |
| RMSD bond angle | 1.628 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.474 | 2.670 |
| High resolution limit [Å] | 2.560 | 2.560 |
| Number of reflections | 9655 | 1023 |
| <I/σ(I)> | 11.4 | |
| Completeness [%] | 94.4 | |
| Redundancy | 5.1 | |
| CC(1/2) | 0.994 | 0.491 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 289 | Tris 8.0, 25% PEG 2000MME |
