Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-09-28 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 40.885, 105.918, 48.657 |
| Unit cell angles | 90.00, 112.52, 90.00 |
Refinement procedure
| Resolution | 52.960 - 1.500 |
| R-factor | 0.12535 |
| Rwork | 0.122 |
| R-free | 0.17913 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5AJF |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.786 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.950 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.070 | 0.500 |
| Number of reflections | 60896 | |
| <I/σ(I)> | 10.9 | 2.6 |
| Completeness [%] | 99.7 | 99.8 |
| Redundancy | 3.7 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.1 M BIS-TRIS, PH 6.5, 25% W/V PEG 3350 |
