2JG1
STRUCTURE OF Staphylococcus aureus D-TAGATOSE-6-PHOSPHATE KINASE with cofactor and substrate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 95.200, 97.090, 154.470 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 24.850 - 2.000 |
R-factor | 0.192 |
Rwork | 0.190 |
R-free | 0.23400 |
Structure solution method | SAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.234 |
Data scaling software | XSCALE |
Phasing software | XPREP |
Refinement software | REFMAC (5.3.0011) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.800 | 2.120 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.090 | 0.620 |
Number of reflections | 96948 | |
<I/σ(I)> | 7.6 | 1.2 |
Completeness [%] | 99.8 | 99.8 |
Redundancy | 10.9 | 9.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.2 M MAGNESIUM ACETATE TETRAHYDRATE, 0.1 M SODIUM CACODYLATE PH 6.5, 10% PEG 8000, 15% PEG 550, 10 MM ATP. |