Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-04-22 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 30.371, 33.671, 66.421 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.050 - 1.170 |
| R-factor | 0.15089 |
| Rwork | 0.150 |
| R-free | 0.17251 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.495 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.190 |
| High resolution limit [Å] | 1.170 | 3.180 | 1.170 |
| Rmerge | 0.052 | 0.042 | 0.214 |
| Rmeas | 0.057 | 0.046 | 0.251 |
| Rpim | 0.022 | 0.018 | 0.129 |
| Total number of observations | 153097 | ||
| Number of reflections | 23321 | 1312 | 936 |
| <I/σ(I)> | 11.5 | ||
| Completeness [%] | 98.3 | 98.9 | 83 |
| Redundancy | 6.6 | 6.3 | 3.3 |
| CC(1/2) | 0.999 | 0.997 | 0.927 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 291 | 12.5% MPD, 12.5% PEG1000, 12.5% PEG3350, 0.1 M Sodium Hepes, MOPS pH 7.5, 0.09 M Sodium nitrate, 0.09 M Sodium phosphate dibasic, 0.09 M Ammonium sulfate |
