7QPS
Structure of Mn-free SpoT
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-08-09 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9801 |
| Spacegroup name | P 41 2 2 |
| Unit cell lengths | 90.887, 90.887, 262.359 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 85.880 - 2.790 |
| R-factor | 0.2602 |
| Rwork | 0.258 |
| R-free | 0.29830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6s2v |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.990 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.4 (20-OCT-2021)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 85.880 | 2.900 |
| High resolution limit [Å] | 2.790 | 2.790 |
| Rmerge | 0.527 | 3.457 |
| Rpim | 0.108 | 0.689 |
| Number of reflections | 25337 | 1230 |
| <I/σ(I)> | 10.1 | |
| Completeness [%] | 94.7 | |
| Redundancy | 24.8 | |
| CC(1/2) | 0.990 | 0.487 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 0.5 M Ammonium sulfate, 1.0 M Lithium sulfate, 0.1 M Sodium citrate, 30 % w/v PEG 1500 |
