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 |