Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-08-25 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.976 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.510, 134.290, 145.020 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.270 - 1.620 |
| R-factor | 0.229 |
| Rwork | 0.228 |
| R-free | 0.24900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.050 |
| Data scaling software | Aimless |
| Refinement software | BUSTER (2.11.7 PACIOREK) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.931 | 1.645 |
| High resolution limit [Å] | 1.617 | 1.617 |
| Rmerge | 0.038 | 0.473 |
| Rmeas | 0.042 | 0.560 |
| Rpim | 0.017 | 0.295 |
| Total number of observations | 728815 | 20523 |
| Number of reflections | 121702 | 5944 |
| <I/σ(I)> | 20.9 | 2.2 |
| Completeness [%] | 99.9 | |
| Redundancy | 6 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 13-18% PEG3350, 0.2-0.35M Am. Cit. pH7.0 |
