Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-09-15 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.9762 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 94.955, 94.955, 225.997 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 87.542 - 2.079 |
| Rwork | 0.198 |
| R-free | 0.23510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.722 |
| Data reduction software | autoPROC |
| Data scaling software | STARANISO |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 87.542 | 2.264 |
| High resolution limit [Å] | 2.079 | 2.079 |
| Rmerge | 0.078 | 1.256 |
| Rmeas | 0.080 | 1.308 |
| Rpim | 0.016 | 0.363 |
| Number of reflections | 48208 | 2411 |
| <I/σ(I)> | 23.1 | 1.7 |
| Completeness [%] | 95.7 | 75.8 |
| Redundancy | 24.8 | |
| CC(1/2) | 1.000 | 0.769 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 0.1 M ammonium tartrate dibasic pH 7.0, 12% (w/v) PEG 3350. |
