Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-1A |
| Synchrotron site | Photon Factory |
| Beamline | BL-1A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-10-30 |
| Detector | DECTRIS EIGER X 4M |
| Wavelength(s) | 1.012 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.596, 76.699, 110.165 |
| Unit cell angles | 90.00, 92.77, 90.00 |
Refinement procedure
| Resolution | 62.920 - 1.650 |
| R-factor | 0.18007 |
| Rwork | 0.179 |
| R-free | 0.20665 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.745 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 62.920 | 1.680 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Number of reflections | 101361 | 4800 |
| <I/σ(I)> | 5.3 | |
| Completeness [%] | 98.2 | |
| Redundancy | 4 | |
| CC(1/2) | 0.977 | 0.534 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M Tris-HCl pH 8.0, 20%(w/v) PEG6000, and 0.2 M CaCl2 |
