3I23
Crystal Structure of an Oxidoreductase (Gfo/Idh/MocA family) from Enterococcus faecalis. Northeast Structural Genomics Consortium target id EfR167
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 | 2009-02-25 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.979 |
Spacegroup name | P 3 |
Unit cell lengths | 91.094, 91.094, 91.481 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.870 - 2.300 |
R-factor | 0.157 |
Rwork | 0.157 |
R-free | 0.20900 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.400 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXS |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.340 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.077 | 0.311 |
Number of reflections | 75646 | |
<I/σ(I)> | 19.1 | 18 |
Completeness [%] | 99.9 | 99 |
Redundancy | 4.8 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 291 | MgAcetate 200 mM, CacAcid Ph6.5,PEG8K, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K |