4GUN
Crystal Structure of the K184R, L185P mutant manganese superoxide dismutase from Candida albicans cytosol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E+ SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2011-11-10 |
| Detector | RIGAKU RAXIS HTC |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 129.330, 73.800, 134.290 |
| Unit cell angles | 90.00, 109.30, 90.00 |
Refinement procedure
| Resolution | 53.020 - 1.940 |
| R-factor | 0.2394 |
| Rwork | 0.238 |
| R-free | 0.26570 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3qvn |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.080 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.3.0) |
| Refinement software | BUSTER-TNT |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 53.020 | 1.990 | |
| High resolution limit [Å] | 1.940 | 8.690 | 1.940 |
| Rmerge | 0.091 | 0.039 | 0.295 |
| Number of reflections | 314901 | 3774 | 16471 |
| <I/σ(I)> | 9.94 | 22.2 | 3.21 |
| Completeness [%] | 91.3 | 97.6 | 64.4 |
| Redundancy | 3.83 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 2 M ammonium sulfate, pH 7.0, vapor diffusion, hanging drop, temperature 277K |
