Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-07-01 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97946 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 67.928, 67.928, 381.657 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.595 - 2.419 |
| R-factor | 0.264 |
| Rwork | 0.260 |
| R-free | 0.34530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.055 |
| Data reduction software | autoPX |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.16_3549: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.595 | 2.506 |
| High resolution limit [Å] | 2.419 | 2.419 |
| Rmerge | 0.553 | 3.309 |
| Rmeas | 0.561 | 3.361 |
| Rpim | 0.094 | 0.577 |
| Number of reflections | 21263 | 1500 |
| <I/σ(I)> | 10 | 1.09 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 34.39 | 32.79 |
| CC(1/2) | 0.998 | 0.362 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2 M Sodium citrate tribasic dihydrate and 18% w/v Polyethylene glycol 3,350 |
