Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-08-07 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.978570 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 85.160, 108.210, 176.650 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.430 - 2.890 |
| R-factor | 0.2122 |
| Rwork | 0.209 |
| R-free | 0.28170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 1.011 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 48.430 | 48.430 | 3.070 |
| High resolution limit [Å] | 2.890 | 8.560 | 2.890 |
| Rmerge | 0.187 | 0.045 | 2.207 |
| Rmeas | 0.199 | 0.048 | 2.349 |
| Total number of observations | 323984 | ||
| Number of reflections | 36847 | 1565 | 5596 |
| <I/σ(I)> | 9.17 | 38.32 | 0.87 |
| Completeness [%] | 99.1 | 99.2 | 94.8 |
| Redundancy | 8.793 | 7.901 | 8.566 |
| CC(1/2) | 0.997 | 0.999 | 0.421 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 13 % PEG 8000, 0.1 mM Imidazole pH 7 |
