Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-08-30 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | .97371 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 52.806, 74.744, 68.419 |
| Unit cell angles | 90.00, 102.56, 90.00 |
Refinement procedure
| Resolution | 51.600 - 1.360 |
| R-factor | 0.17445 |
| Rwork | 0.173 |
| R-free | 0.20472 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.522 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0232) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 51.600 | 1.494 |
| High resolution limit [Å] | 1.360 | 1.368 |
| Rmeas | 0.074 | 0.791 |
| Number of reflections | 69032 | 3584 |
| <I/σ(I)> | 9.9 | |
| Completeness [%] | 82.0 | |
| Redundancy | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1M KSCN 25% PEG 3350 |
