Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-12-14 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.91188 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 84.020, 84.020, 150.220 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 24.438 - 1.470 |
| Rwork | 0.179 |
| R-free | 0.20830 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 6gj0 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.901 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.440 | 1.500 |
| High resolution limit [Å] | 1.470 | 1.470 |
| Rmerge | 0.053 | 2.019 |
| Rmeas | 2.123 | |
| Rpim | 0.022 | 0.652 |
| Number of reflections | 104886 | 5118 |
| <I/σ(I)> | 20.4 | 1.2 |
| Completeness [%] | 100.0 | |
| Redundancy | 11 | |
| CC(1/2) | 1.000 | 0.498 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 0.2M MnS04, 0.1M MES, 28% PEG4000 and pH 5.5 |
