3KSG
structure of fRMsr of Staphylococcus aureus (complex with substrate)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 4A |
Synchrotron site | PAL/PLS |
Beamline | 4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-07-02 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.2386 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 41.582, 87.492, 42.862 |
Unit cell angles | 90.00, 101.25, 90.00 |
Refinement procedure
Resolution | 37.890 - 2.300 |
R-factor | 0.222 |
Rwork | 0.222 |
R-free | 0.25200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1vhm |
RMSD bond length | 0.010 |
RMSD bond angle | 1.500 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.300 |
Number of reflections | 13036 |
Completeness [%] | 97.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 295 | 0.1M MES pH6.0, 22% PEG 400, VAPOR DIFFUSION, HANGING DROP, temperature 295K |