6KMN
Crystal Structure of Dye Decolorizing peroxidase from Bacillus subtilis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-09-28 |
| Detector | DECTRIS EIGER R 4M |
| Wavelength(s) | 0.96770 |
| Spacegroup name | P 1 |
| Unit cell lengths | 58.841, 71.176, 101.014 |
| Unit cell angles | 69.59, 83.58, 80.56 |
Refinement procedure
| Resolution | 48.150 - 2.440 |
| R-factor | 0.178 |
| Rwork | 0.175 |
| R-free | 0.24280 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6kmm |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.636 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0253) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.150 | 2.480 |
| High resolution limit [Å] | 2.440 | 2.440 |
| Number of reflections | 52522 | 2534 |
| <I/σ(I)> | 11.2 | 2.1 |
| Completeness [%] | 93.3 | 90.5 |
| Redundancy | 9.7 | 9.5 |
| CC(1/2) | 0.990 | 0.490 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 25% MPD, 0.05 M HEPES |
