2XR8
Crystal structure of biphenyl dioxygenase from Burkholderia xenovorans LB400
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 14-ID-B |
Synchrotron site | APS |
Beamline | 14-ID-B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-07-25 |
Detector | ADSC SX-165 |
Spacegroup name | P 1 |
Unit cell lengths | 132.585, 132.350, 132.984 |
Unit cell angles | 102.60, 102.68, 104.61 |
Refinement procedure
Resolution | 129.100 - 2.490 |
R-factor | 0.21649 |
Rwork | 0.216 |
R-free | 0.26714 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gzy |
RMSD bond length | 0.006 |
RMSD bond angle | 0.925 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 120.000 | 2.600 |
High resolution limit [Å] | 2.490 | 2.490 |
Rmerge | 0.100 | 0.410 |
Number of reflections | 255418 | |
<I/σ(I)> | 6.8 | 1.4 |
Completeness [%] | 89.0 | 30 |
Redundancy | 2.8 | 1.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | pH 6 |