3F0I
Arsenate reductase from Vibrio cholerae.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-10-02 |
Detector | SBC-3 |
Spacegroup name | P 64 2 2 |
Unit cell lengths | 118.704, 118.704, 110.013 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 31.700 - 1.880 |
R-factor | 0.167 |
Rwork | 0.166 |
R-free | 0.18900 |
Structure solution method | SAD |
RMSD bond length | 0.018 |
RMSD bond angle | 1.534 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELXD |
Refinement software | REFMAC (5.5.0054) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.700 | 1.910 |
High resolution limit [Å] | 1.880 | 1.880 |
Rmerge | 0.090 | 0.764 |
Number of reflections | 37716 | |
<I/σ(I)> | 39.832 | 2.04 |
Completeness [%] | 99.9 | 99.8 |
Redundancy | 13.7 | 8.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 289 | 2.4 M sodium malonate, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |