6EX4
Staphylococcus aureus cambialistic superoxide dismutase SodM
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-12-07 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.980 |
| Spacegroup name | P 61 |
| Unit cell lengths | 141.954, 141.954, 46.159 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.470 - 2.400 |
| R-factor | 0.17645 |
| Rwork | 0.174 |
| R-free | 0.21929 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2rcv |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.462 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.470 | 2.490 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Number of reflections | 21099 | |
| <I/σ(I)> | 7.6 | 1.6 |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 3.3 | 3.3 |
| CC(1/2) | 0.993 | 0.644 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 100 mM PCTB pH 7.0 and 25% (w/v) PEG 1500 |
