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 | 2018-11-29 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | .97625 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 52.689, 74.025, 68.701 |
| Unit cell angles | 90.00, 102.64, 90.00 |
Refinement procedure
| Resolution | 51.470 - 1.490 |
| R-factor | 0.19929 |
| Rwork | 0.198 |
| R-free | 0.23248 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.490 |
| 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] | 51.470 | 1.537 |
| High resolution limit [Å] | 1.485 | 1.485 |
| Rmeas | 0.167 | 1.758 |
| Number of reflections | 73987 | 3964 |
| <I/σ(I)> | 6.8 | |
| Completeness [%] | 84.1 | 56.9 |
| Redundancy | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | F4 .1M KSCN 25% PEG 3350 |
