2VRO
Crystal structure of aldehyde dehydrogenase from Burkholderia xenovorans LB400
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2007-12-05 |
Detector | RAXIS 4 |
Spacegroup name | P 1 |
Unit cell lengths | 57.980, 67.690, 77.620 |
Unit cell angles | 111.18, 90.48, 113.27 |
Refinement procedure
Resolution | 37.820 - 1.600 |
R-factor | 0.209 |
Rwork | 0.207 |
R-free | 0.23800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1qi1 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.481 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.310 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.060 | 0.360 |
Number of reflections | 121689 | |
<I/σ(I)> | 10.4 | 2.5 |
Completeness [%] | 92.6 | 88.1 |
Redundancy | 3.67 | 3.17 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | pH 6 |