Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-10-10 |
| Detector | DECTRIS PILATUS 300K |
| Wavelength(s) | 0.9724 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 141.847, 65.161, 116.426 |
| Unit cell angles | 90.00, 103.75, 90.00 |
Refinement procedure
| Resolution | 113.089 - 1.800 |
| Rwork | 0.227 |
| R-free | 0.26260 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | Internal Model |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.598 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 113.090 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.054 | 0.374 |
| Rmeas | 0.064 | |
| Number of reflections | 93293 | 4573 |
| <I/σ(I)> | 14.4 | |
| Completeness [%] | 97.6 | |
| Redundancy | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | ethylene glycol per PEG 8000, carboxylic acids mix, buffer system 2, |
