5A12
Crystal structure of Chlorite Dismutase from Magnetospirillum sp. in complex with azide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 77 |
| Detector technology | PIXEL |
| Collection date | 2013-12-12 |
| Detector | DECTRIS PILATUS |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 74.234, 133.823, 77.622 |
| Unit cell angles | 90.00, 113.03, 90.00 |
Refinement procedure
| Resolution | 71.440 - 1.400 |
| R-factor | 0.11994 |
| Rwork | 0.118 |
| R-free | 0.15434 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3q08 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.519 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.840 | 1.420 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.020 | 0.740 |
| Number of reflections | 268333 | |
| <I/σ(I)> | 11.4 | 1.4 |
| Completeness [%] | 98.4 | 94.2 |
| Redundancy | 3.8 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6 | 16% PEG 6000, 0.01M SODIUM CITRATE |
