6LL1
Oxygen-exposed reduced terminal oxygenase in 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] | 95 |
| Detector technology | CCD |
| Collection date | 2017-11-21 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 65 |
| Unit cell lengths | 91.738, 91.738, 240.024 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 79.450 - 2.150 |
| R-factor | 0.1556 |
| Rwork | 0.153 |
| R-free | 0.20898 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ww9 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.860 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.000 | 2.190 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.096 | 0.722 |
| Number of reflections | 61883 | 3101 |
| <I/σ(I)> | 39.5 | |
| Completeness [%] | 100.0 | |
| Redundancy | 22.7 |
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 |
