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 | 2023-09-14 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.99986 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 81.659, 83.123, 146.514 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 72.300 - 2.313 |
R-factor | 0.2185 |
Rwork | 0.218 |
R-free | 0.23530 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.960 |
Data scaling software | Aimless |
Refinement software | BUSTER (2.11.8) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 72.300 | 2.577 |
High resolution limit [Å] | 2.310 | 2.313 |
Number of reflections | 31148 | 1557 |
<I/σ(I)> | 11.9 | |
Completeness [%] | 94.2 | |
Redundancy | 13.7 | |
CC(1/2) | 1.000 | 0.700 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293.15 | 0.1 M ammonium acetate, 17% PEG 10,000, 0.1M BIS-TRIS pH 5.5 |