6XAB
Structure of the acetate-bound 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 | 2019-03-02 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.953 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.663, 52.927, 54.967 |
| Unit cell angles | 90.00, 108.36, 90.00 |
Refinement procedure
| Resolution | 40.670 - 1.781 |
| Rwork | 0.189 |
| R-free | 0.22160 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6x6b |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.316 |
| 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] | 40.670 | 1.820 |
| High resolution limit [Å] | 1.780 | 1.780 |
| Number of reflections | 23640 | 1257 |
| <I/σ(I)> | 4.4 | |
| Completeness [%] | 96.7 | |
| Redundancy | 2.8 | |
| CC(1/2) | 0.992 | 0.374 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2 M ammonium acetate, 0.1 M Tris pH 7.5, 20% (w/v) PEG 3350 |
