Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL45XU |
| Synchrotron site | SPring-8 |
| Beamline | BL45XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-05-16 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 136.770, 34.950, 46.210 |
| Unit cell angles | 90.00, 99.26, 90.00 |
Refinement procedure
| Resolution | 40.970 - 1.880 |
| R-factor | 0.2222 |
| Rwork | 0.221 |
| R-free | 0.25080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.729 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.990 |
| High resolution limit [Å] | 1.880 | 1.880 |
| Rmerge | 0.282 | 1.924 |
| Number of reflections | 17379 | 2707 |
| <I/σ(I)> | 4.5 | 0.7 |
| Completeness [%] | 97.1 | 98 |
| Redundancy | 6.7 | 6.7 |
| CC(1/2) | 0.433 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1.6 M sodium citrate tribasic dihydrate pH 6.5 |
