2P1R
Crystal structure of Salmonella typhimurium YegS, a putative lipid kinase homologous to eukaryotic sphingosine and diacylglycerol kinases.
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-09-04 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.885596, 0.979239, 0.885596 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 107.000, 70.990, 102.160 |
Unit cell angles | 90.00, 118.51, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.500 |
Rwork | 0.206 |
R-free | 0.25500 |
Structure solution method | MAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.300 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELXS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.114 | 0.550 |
Number of reflections | 45865 | |
<I/σ(I)> | 14.46 | 1.74 |
Completeness [%] | 97.6 | 83.6 |
Redundancy | 6.2 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 277 | pH 7.4, 17% PEG3350, 0.2M ammonium sulphate. VAPOR DIFFUSION, SITTING DROP, temperature 277K |