Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-07-11 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.928190 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 36.739, 60.850, 67.530 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.205 - 1.300 |
| Rwork | 0.159 |
| R-free | 0.20650 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.428 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 67.530 | 1.320 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.061 | 0.693 |
| Number of reflections | 38033 | 1936 |
| <I/σ(I)> | 13.4 | |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 6.5 | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 30% PEG8000, 0.2 M lithium sulfate and 0.1 M acetate pH 4.5 |
