1WVI
Crystal structure of putative phosphatase from Streptococcus mutans UA159
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X9A |
Synchrotron site | NSLS |
Beamline | X9A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-08-16 |
Detector | MARRESEARCH |
Wavelength(s) | 0.97934, 0.97911, 0.97166 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 63.644, 107.418, 81.940 |
Unit cell angles | 90.00, 97.40, 90.00 |
Refinement procedure
Resolution | 25.000 - 2.300 |
R-factor | 0.248 |
Rwork | 0.248 |
R-free | 0.26400 |
Structure solution method | MAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.380 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Number of reflections | 47794 | |
Completeness [%] | 98.4 | 96.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 293 | PEG2000, Thiocyanate, pH 7.0, VAPOR DIFFUSION, temperature 293.0K |