Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-07-25 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 65 |
| Unit cell lengths | 115.624, 115.624, 113.270 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 28.910 - 2.060 |
| R-factor | 0.2125 |
| Rwork | 0.211 |
| R-free | 0.23920 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.942 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.21.1_5286_000) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 30.000 | 30.000 | 2.130 |
| High resolution limit [Å] | 2.060 | 4.430 | 2.060 |
| Rmerge | 0.057 | 0.037 | 0.524 |
| Rmeas | 0.042 | 0.584 | |
| Rpim | 0.019 | 0.257 | |
| Number of reflections | 52682 | 5020 | 5290 |
| <I/σ(I)> | 13.9 | ||
| Completeness [%] | 99.3 | 93 | 100 |
| Redundancy | 5 | 4.7 | 5.1 |
| CC(1/2) | 0.997 | 0.946 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | isopropanol, Bis-Tris pH 7.1, PEG 200, PEG 1000 |
