2OOG
Crystal structure of glycerophosphoryl diester phosphodiesterase from Staphylococcus aureus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-16 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.97940 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 156.312, 183.546, 176.790 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.200 |
R-factor | 0.2362 |
Rwork | 0.235 |
R-free | 0.28044 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ydy |
RMSD bond length | 0.008 |
RMSD bond angle | 1.133 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.058 | 0.320 |
Number of reflections | 124065 | |
<I/σ(I)> | 8 | 1.8 |
Completeness [%] | 97.1 | 97.1 |
Redundancy | 5.7 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 294 | O.1M HEPES PH 7.5, 25% PEG 3350, 0.2M AMMONIUM SULFATE, 10% GLYCEROL, VAPOR DIFFUSION, SITTING DROP, temperature 294K |