8P6M
Arsenate reductase (ArsC2) from Deinococcus indicus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-11-02 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9793 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.673, 39.401, 72.385 |
| Unit cell angles | 90.00, 97.38, 90.00 |
Refinement procedure
| Resolution | 19.700 - 1.650 |
| R-factor | 0.225 |
| Rwork | 0.224 |
| R-free | 0.25350 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.674 |
| Data reduction software | XDS |
| Data scaling software | STARANISO |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.700 | 1.680 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.100 | 0.750 |
| Rpim | 0.077 | 0.550 |
| Number of reflections | 25923 | 994 |
| <I/σ(I)> | 8.4 | 2 |
| Completeness [%] | 87.3 | |
| Redundancy | 2.5 | |
| CC(1/2) | 0.993 | 0.485 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277.15 | 0.2M Sodium Acetate trihdrate, 0.1M Tris-HCl, 20% PEG 4000 |
