Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE MASSIF-1 |
| Synchrotron site | ESRF |
| Beamline | MASSIF-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-06-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9897 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 77.393, 65.265, 74.271 |
| Unit cell angles | 90.00, 91.23, 90.00 |
Refinement procedure
| Resolution | 49.020 - 1.880 |
| R-factor | 0.2279 |
| Rwork | 0.227 |
| R-free | 0.26540 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.080 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.020 | 1.950 |
| High resolution limit [Å] | 1.880 | 1.880 |
| Number of reflections | 106852 | 4745 |
| <I/σ(I)> | 8.85 | |
| Completeness [%] | 96.8 | |
| Redundancy | 3.1 | |
| CC(1/2) | 0.995 | 0.658 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 12% PEG3350, 50-90 mM Ammonium |
