8U09
Crystal structure of substrate-free SyoA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-06-27 |
Detector | DECTRIS EIGER2 X 9M |
Wavelength(s) | 0.9537 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 54.860, 150.242, 60.642 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.190 - 1.980 |
R-factor | 0.1737 |
Rwork | 0.172 |
R-free | 0.20500 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 0.849 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.190 | 2.050 |
High resolution limit [Å] | 1.980 | 1.980 |
Rmerge | 0.117 | 0.631 |
Number of reflections | 35630 | 3483 |
<I/σ(I)> | 19.8 | 4.1 |
Completeness [%] | 98.3 | 98.8 |
Redundancy | 13.5 | |
CC(1/2) | 0.999 | 0.939 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 289 | 0.1 M sodium acetate, pH 5, 5% w/v gamma-PGA, 12% w/v PEG8000 |