7L22
Structure of chloride soak form of ArrX from Chrysiogenes arsenatis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-11-05 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.95372 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 52.896, 54.477, 90.844 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.720 - 1.925 |
Rwork | 0.169 |
R-free | 0.21350 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6x6b |
RMSD bond length | 0.009 |
RMSD bond angle | 1.483 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0253) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.720 | 1.970 |
High resolution limit [Å] | 1.920 | 1.920 |
Number of reflections | 20389 | 1173 |
<I/σ(I)> | 20 | |
Completeness [%] | 99.0 | |
Redundancy | 20 | |
CC(1/2) | 1.000 | 0.857 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.2 M lithium chloride, 0.1 M Tris pH 8.5, 27% (w/v) PEG 3350 |