2Q2Q
Structure of D-3-Hydroxybutyrate Dehydrogenase from Pseudomonas putida
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-02-21 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5419 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 261.457, 59.913, 116.523 |
Unit cell angles | 90.00, 113.70, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.020 |
R-factor | 0.202 |
Rwork | 0.199 |
R-free | 0.27400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wmb |
RMSD bond length | 0.028 |
RMSD bond angle | 2.281 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.090 |
High resolution limit [Å] | 2.020 | 2.020 |
Rmerge | 0.593 | |
Number of reflections | 105219 | |
Completeness [%] | 96.7 | 74.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.1 | 295 | 17-20 % PEG 1500, 0.2mM calcium chloride, 10mM acetoacetate, pH 7.1, VAPOR DIFFUSION, HANGING DROP, temperature 295K |