Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2) |
| Synchrotron site | PETRA III, EMBL c/o DESY |
| Beamline | P14 (MX2) |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-09-16 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.976264 |
| Spacegroup name | P 63 2 2 |
| Unit cell lengths | 99.160, 99.160, 112.180 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.580 - 2.450 |
| Rwork | 0.205 |
| R-free | 0.27430 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.631 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 10.960 | 2.510 |
| High resolution limit [Å] | 2.450 | 7.750 | 2.450 |
| Rmerge | 0.379 | 0.081 | 3.429 |
| Rmeas | 0.385 | 0.083 | 3.473 |
| Number of reflections | 12518 | 295 | 884 |
| <I/σ(I)> | 17.4 | ||
| Completeness [%] | 100.0 | ||
| Redundancy | 37 | ||
| CC(1/2) | 0.998 | 0.999 | 0.792 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1.5 M Lithium sulfate 0.05 M TRIS pH 8.5 5 % (v/v) Glycerol 0.005 M Magnesium chloride |
