3OSU
Crystal structure of the 3-oxoacyl-acyl carrier protein reductase, FabG, from Staphylococcus aureus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2009-07-31 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97872 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 64.060, 64.060, 183.890 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 32.030 - 1.900 |
R-factor | 0.159 |
Rwork | 0.157 |
R-free | 0.19310 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 0.978 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELXS |
Refinement software | PHENIX (dev_501) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.970 |
High resolution limit [Å] | 1.900 | 4.090 | 1.900 |
Rmerge | 0.088 | 0.045 | 0.663 |
Number of reflections | 66682 | ||
<I/σ(I)> | 19.1 | 28.7 | 2.6 |
Completeness [%] | 99.9 | 99.2 | 100 |
Redundancy | 6.5 | 6.6 | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 295 | 30% PEG 400,100mM Potassium Chloride, 10mM Magnesium Chloride, 50mM Tris, pH 9, VAPOR DIFFUSION, HANGING DROP, temperature 295K |