9SDC
RelSI toxin-antitoxin complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-07-10 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 67.854, 76.955, 137.551 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 68.780 - 1.700 |
| R-factor | 0.1895 |
| Rwork | 0.188 |
| R-free | 0.21900 |
| Structure solution method | AB INITIO PHASING |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.539 |
| Data reduction software | xia2.multiplex |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (v1.21.2-5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 68.780 | 1.720 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.049 | 0.015 |
| Rmeas | 0.069 | 0.021 |
| Number of reflections | 79918 | 2803 |
| <I/σ(I)> | 1.14 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 1.9 | 1.9 |
| CC(1/2) | 0.998 | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 294 | 0.1 M Sodium acetate pH 5.5, 40% v/v MPD |
