3DC5
Crystal Structure of a manganese superoxide dismutases from Caenorhabditis elegans
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-05-25 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.060 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 81.780, 81.780, 136.031 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.070 - 1.700 |
| R-factor | 0.1912 |
| Rwork | 0.189 |
| R-free | 0.22596 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1n0j |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.398 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.070 | 1.790 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.076 | 0.364 |
| Number of reflections | 49346 | |
| <I/σ(I)> | 5 | 2.9 |
| Completeness [%] | 96.2 | 95.8 |
| Redundancy | 3.7 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9.2 | 291 | 2.7M ammonium sulphate, 0.1M bicine, pH9.2, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
