Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-04-09 |
| Detector | DECTRIS PILATUS3 X 2M |
| Wavelength(s) | 0.873128 |
| Spacegroup name | P 1 |
| Unit cell lengths | 97.665, 126.036, 148.393 |
| Unit cell angles | 96.36, 104.81, 84.23 |
Refinement procedure
| Resolution | 19.970 - 1.500 |
| R-factor | 0.2007 |
| Rwork | 0.200 |
| R-free | 0.23160 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | unpublished |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.010 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.4) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.634 | 1.635 |
| High resolution limit [Å] | 1.499 | 1.499 |
| Rmerge | 0.122 | 0.705 |
| Rmeas | 0.151 | 0.866 |
| Rpim | 0.087 | 0.497 |
| Number of reflections | 744804 | 37234 |
| <I/σ(I)> | 5.444 | 1.569 |
| Completeness [%] | 90.0 | 63.75 |
| Redundancy | 2.76 | 2.89 |
| CC(1/2) | 0.992 | 0.466 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293.15 | 0.2 M lithium sulfate 0.1 M Bis-Tris pH 6.5 18 % PEG 3350 |
