1YUD
X-ray Crystal Structure of Protein SO0799 from Shewanella oneidensis. Northeast Structural Genomics Consortium Target SoR12.
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-06-21 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.97624, 0.97895, 0.97020 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 98.441, 94.100, 117.100 |
Unit cell angles | 90.00, 111.80, 90.00 |
Refinement procedure
Resolution | 29.930 - 2.700 |
R-factor | 0.237 |
Rwork | 0.237 |
R-free | 0.29200 |
Structure solution method | MAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.500 |
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 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.072 | 0.775 |
Number of reflections | 105384 | |
<I/σ(I)> | 22 | 1.5 |
Redundancy | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 100 mM Hepes, 22% PEG3350, 200 mM ammonium sulphate, 5 mM DTT, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |