2XRX
CRYSTAL STRUCTURE OF BIPHENYL DIOXYGENASE IN COMPLEX WITH BIPHENYL 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 | 2004-02-19 |
| Detector | ADSC SX-165 |
| Spacegroup name | P 1 |
| Unit cell lengths | 132.824, 132.646, 130.423 |
| Unit cell angles | 102.65, 101.11, 105.31 |
Refinement procedure
| Resolution | 119.520 - 2.420 |
| R-factor | 0.23302 |
| Rwork | 0.233 |
| R-free | 0.27031 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2xr8 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.905 |
| 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] | 100.000 | 2.480 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.060 | 0.270 |
| Number of reflections | 309885 | |
| <I/σ(I)> | 13.8 | 2.2 |
| Completeness [%] | 93.0 | 74 |
| Redundancy | 2.7 | 1.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6 | PROTEIN WAS CRYSTALLIZED FROM 20% PEG 5000MME, 50 MM PIPES, PH 6.5. |
