Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-02-05 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.99999 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 90.890, 109.080, 142.440 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.450 - 2.500 |
| R-factor | 0.2327 |
| Rwork | 0.230 |
| R-free | 0.27760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6pyr |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.559 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.450 | 2.580 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.041 | 1.193 |
| Rmeas | 0.045 | 1.296 |
| Rpim | 0.017 | 0.499 |
| Number of reflections | 49670 | 4525 |
| <I/σ(I)> | 18.7 | 1.6 |
| Completeness [%] | 99.9 | 99.7 |
| Redundancy | 6.7 | 6.7 |
| CC(1/2) | 1.000 | 0.858 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.8 | 283.15 | 10% PEG 4000, 100 mM KCl, 1 mM TCEP neutral pH, 10 mM CaCl2, 100 mM MES pH 5.8 |
