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 | 2022-12-14 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 0.9995 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 98.150, 81.226, 51.732 |
Unit cell angles | 90.00, 114.78, 90.00 |
Refinement procedure
Resolution | 47.010 - 1.476 |
R-factor | 0.1386 |
Rwork | 0.135 |
R-free | 0.17690 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.388 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.010 | 1.500 |
High resolution limit [Å] | 1.470 | 1.470 |
Rmerge | 0.056 | |
Number of reflections | 261893 | 13119 |
<I/σ(I)> | 10.1 | |
Completeness [%] | 96.1 | |
Redundancy | 4.5 | |
CC(1/2) | 0.824 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | PCB: 0.100000 M pH:6.00 ; PEG 1500: 25.000000 %w/v |