6JOV
Crystal structure of a hypothetical Fe Superoxide dismutase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-11-02 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 1 |
| Unit cell lengths | 55.018, 55.088, 74.623 |
| Unit cell angles | 82.28, 89.61, 68.49 |
Refinement procedure
| Resolution | 44.895 - 1.941 |
| R-factor | 0.1837 |
| Rwork | 0.181 |
| R-free | 0.22680 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1my6 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.837 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.330 | 1.990 |
| High resolution limit [Å] | 1.940 | 1.940 |
| Rmerge | 0.310 | |
| Rmeas | 0.080 | 0.370 |
| Rpim | 0.040 | 0.190 |
| Number of reflections | 58082 | 3866 |
| <I/σ(I)> | 12.5 | |
| Completeness [%] | 97.3 | 96.6 |
| Redundancy | 3.5 | 3.5 |
| CC(1/2) | 0.997 | 0.910 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M Tris 8.0 and 20% PEG 1000 |
