3D0K
Crystal structure of the LpqC, poly(3-hydroxybutyrate) depolymerase from Bordetella parapertussis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-04-23 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97920 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 41.879, 83.710, 90.792 |
Unit cell angles | 90.00, 92.68, 90.00 |
Refinement procedure
Resolution | 41.830 - 1.830 |
R-factor | 0.166 |
Rwork | 0.164 |
R-free | 0.20900 |
Structure solution method | SAD |
RMSD bond length | 0.019 |
RMSD bond angle | 1.639 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.830 | 1.860 |
High resolution limit [Å] | 1.830 | 1.830 |
Number of reflections | 54978 | |
<I/σ(I)> | 8.5 | 2 |
Completeness [%] | 99.8 | 99.7 |
Redundancy | 4.5 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 289 | 1.6 M Ammonium sulfate, 0.1 M MES pH 6.5, 10% Dioxane, VAPOR DIFFUSION, SITTING DROP, temperature 289K |