8EM5
Mycobacterium thermoresistible MmpS5
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-11-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.284, 85.257, 89.124 |
| Unit cell angles | 90.00, 95.19, 90.00 |
Refinement procedure
| Resolution | 40.080 - 1.950 |
| R-factor | 0.1645 |
| Rwork | 0.161 |
| R-free | 0.19410 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.056 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | AutoSol |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.080 | 2.000 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.124 | 0.743 |
| Rmeas | 0.162 | 0.969 |
| Rpim | 0.079 | 0.455 |
| Number of reflections | 51815 | 3435 |
| <I/σ(I)> | 7.8 | 1.8 |
| Completeness [%] | 95.0 | 89.9 |
| Redundancy | 4.3 | 4.1 |
| CC(1/2) | 0.992 | 0.713 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.2 M sodium iodide, 0.1 M Bis-Tris pH 6.5, 25% PEG3350 |
