Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-07-11 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.710, 76.850, 178.650 |
| Unit cell angles | 90.00, 97.30, 90.00 |
Refinement procedure
| Resolution | 48.810 - 2.640 |
| R-factor | 0.2594 |
| Rwork | 0.259 |
| R-free | 0.26410 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.870 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | SHELXCD |
| Refinement software | BUSTER (2.10.4 (3-FEB-2022)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.810 | 2.710 |
| High resolution limit [Å] | 2.640 | 2.640 |
| Number of reflections | 45042 | 2252 |
| <I/σ(I)> | 16 | |
| Completeness [%] | 89.0 | |
| Redundancy | 13.6 | |
| CC(1/2) | 0.998 | 0.429 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2M Lithium chloride 24% PEG 3350 0.1M MES pH 5.5 |
