Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-11-03 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 1.12713 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 96.620, 96.620, 147.100 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 30.000 - 2.980 |
| R-factor | 0.2113 |
| Rwork | 0.210 |
| R-free | 0.23700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 1.193 |
| Data reduction software | HKL-2000 |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 48.310 | 48.310 | 3.060 |
| High resolution limit [Å] | 2.980 | 13.330 | 2.980 |
| Rmerge | 0.270 | 0.069 | 1.890 |
| Rmeas | 0.277 | 0.071 | 1.936 |
| Rpim | 0.061 | 0.017 | 0.419 |
| Total number of observations | 338579 | 3658 | 25460 |
| Number of reflections | 16789 | 229 | 1205 |
| <I/σ(I)> | 11.6 | 30.9 | 2 |
| Completeness [%] | 100.0 | 98.4 | 99.9 |
| Redundancy | 20.2 | 16 | 21.1 |
| CC(1/2) | 0.997 | 0.999 | 0.763 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 0.2 M Potassium sodium tartrate tetrahydrate 2.0 M Ammonium sulfate 0.1 M Sodium citrate 5.6 |
