Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-04-13 |
| Detector | DECTRIS EIGER X 4M |
| Wavelength(s) | 0.9762 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 60.605, 60.605, 502.608 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 83.768 - 2.288 |
| Rwork | 0.226 |
| R-free | 0.29480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.374 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 83.768 | 2.646 |
| High resolution limit [Å] | 2.288 | 2.288 |
| Rmerge | 0.335 | 2.541 |
| Number of reflections | 9387 | 469 |
| <I/σ(I)> | 10.3 | 1.8 |
| Completeness [%] | 85.8 | |
| Redundancy | 35.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 277 | 0.2 M ammonium acetate, 0.1 M citrate pH 5.5, 30 % PEG4000 |
