Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL10U2 |
Synchrotron site | SSRF |
Beamline | BL10U2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-12-24 |
Detector | DECTRIS EIGER2 S 9M |
Wavelength(s) | 0.97915 |
Spacegroup name | P 1 |
Unit cell lengths | 46.177, 54.042, 83.265 |
Unit cell angles | 72.88, 85.96, 71.78 |
Refinement procedure
Resolution | 48.520 - 2.290 |
Rwork | 0.218 |
R-free | 0.26380 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 0.620 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 79.550 | 2.370 |
High resolution limit [Å] | 2.290 | 2.290 |
Rmerge | 0.099 | |
Number of reflections | 31319 | 3107 |
<I/σ(I)> | 2.4 | |
Completeness [%] | 95.2 | 95.5 |
Redundancy | 1.7 | |
CC(1/2) | 0.546 | 0.547 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 289.15 | 20% PEG3350 and 200 mM ammonium phosphate dibasic |