Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-07-17 |
| Detector | DECTRIS PILATUS |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.150, 83.660, 58.680 |
| Unit cell angles | 90.00, 95.18, 90.00 |
Refinement procedure
| Resolution | 17.766 - 2.640 |
| R-factor | 0.2276 |
| Rwork | 0.226 |
| R-free | 0.25780 |
| Structure solution method | SAD |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.725 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((PHENIX.REFINE: 1.8.4_1496)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 17.770 | 2.710 |
| High resolution limit [Å] | 2.640 | 2.640 |
| Rmerge | 0.100 | 0.680 |
| Number of reflections | 13630 | |
| <I/σ(I)> | 16.1 | 2.4 |
| Completeness [%] | 99.4 | 99.2 |
| Redundancy | 6.7 | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.4 | 20% PEG3350, 0.1M TRIS PH 8.4, 0.2M MAGNESIUM CHLORIDE |
