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 | 2023-11-11 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.98 |
| Spacegroup name | H 3 |
| Unit cell lengths | 46.709, 46.709, 102.923 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 37.650 - 1.040 |
| R-factor | 0.1687 |
| Rwork | 0.168 |
| R-free | 0.17390 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.171 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 67.650 | 1.060 |
| High resolution limit [Å] | 1.040 | 1.040 |
| Rmerge | 0.099 | 0.144 |
| Rmeas | 0.104 | 0.204 |
| Rpim | 0.033 | 0.144 |
| Number of reflections | 32889 | 166 |
| <I/σ(I)> | 12.7 | 2.1 |
| Completeness [%] | 81.2 | 8.3 |
| Redundancy | 8.5 | 1 |
| CC(1/2) | 0.993 | 0.943 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 1.2 M ammonium sulfate, 0.1 M tri-Sodium citrate pH 5.0 |
