5FW4
Structure of Thermobifida fusca DyP-type Peroxidase and Activity towards Kraft Lignin and Lignin Model Compounds
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-10-11 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 143.360, 110.210, 46.730 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.210 - 1.800 |
| R-factor | 0.20605 |
| Rwork | 0.204 |
| R-free | 0.24927 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4gs1 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.641 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.000 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.070 | 0.440 |
| Number of reflections | 69391 | |
| <I/σ(I)> | 14.7 | 3.2 |
| Completeness [%] | 99.8 | 99.8 |
| Redundancy | 5.1 | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | 20% PEG 3350, 100 MM BIS TRIS PROPANE PH 8.5, 0.2 M SODIUM BROMIDE |
