Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-06-16 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 56.703, 78.341, 70.754 |
| Unit cell angles | 90.00, 91.71, 90.00 |
Refinement procedure
| Resolution | 44.890 - 1.810 |
| R-factor | 0.1847 |
| Rwork | 0.183 |
| R-free | 0.22090 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.832 |
| 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] | 45.920 | 1.850 |
| High resolution limit [Å] | 1.810 | 1.810 |
| Rmerge | 0.118 | 1.907 |
| Rmeas | 0.128 | 2.058 |
| Rpim | 0.048 | 0.769 |
| Total number of observations | 23708 | |
| Number of reflections | 56455 | 3330 |
| <I/σ(I)> | 9.3 | 1.6 |
| Completeness [%] | 100.0 | |
| Redundancy | 7 | 7.1 |
| CC(1/2) | 0.983 | 0.799 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1M Bis-Tris propane (pH~7.5), 0.2M Sodium Formate or Fluoride, 10% Ethylene Glycol, ~25% PEG3350 |
