3RGT
Crystal structure of d-mannonate dehydratase from Chromohalobacter salexigens complexed with D-Arabinohydroxamate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-03-18 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.97915 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 110.712, 179.657, 85.422 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.848 - 1.900 |
R-factor | 0.1798 |
Rwork | 0.178 |
R-free | 0.22190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ow1 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.058 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | BALBES |
Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 39.848 |
High resolution limit [Å] | 1.900 |
Number of reflections | 133334 |
Completeness [%] | 99.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 20% Polyvinylpyrrolidone, 0.1M Tris, 0.01M Cobalt chloride, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |