7BUG
Reduced oxygenase of carbazole 1,9a-dioxygenase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-11-22 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0 |
Spacegroup name | P 65 |
Unit cell lengths | 91.940, 91.940, 243.460 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.010 - 1.600 |
R-factor | 0.1554 |
Rwork | 0.154 |
R-free | 0.18790 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ww9 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.836 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 1.630 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.122 | 1.576 |
Number of reflections | 152740 | 7547 |
<I/σ(I)> | 18.7 | |
Completeness [%] | 100.0 | |
Redundancy | 21.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.05 M MgCl2, 0.1 M HEPES pH 7.5, 30% (v/v) PEG MME 550 |