Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 11.2C |
| Synchrotron site | ELETTRA |
| Beamline | 11.2C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-11-22 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 58.352, 46.394, 63.356 |
| Unit cell angles | 90.00, 111.57, 90.00 |
Refinement procedure
| Resolution | 36.450 - 1.500 |
| R-factor | 0.1646 |
| Rwork | 0.163 |
| R-free | 0.19330 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.865 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 58.920 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.058 | 0.771 |
| Rmeas | 0.063 | 0.838 |
| Rpim | 0.025 | 0.323 |
| Total number of observations | 322530 | 16053 |
| Number of reflections | 50608 | 2447 |
| <I/σ(I)> | 16.2 | 2.5 |
| Completeness [%] | 99.9 | |
| Redundancy | 6.4 | 6.6 |
| CC(1/2) | 0.999 | 0.850 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 32% PEG4000, 0.2 M Lithium Sulfate |
