2IUF
The structures of Penicillium vitale catalase: resting state, oxidised state (compound I) and complex with aminotriazole
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 120 |
| Detector technology | IMAGE PLATE |
| Detector | RIGAKU RAXIS II |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 142.440, 142.440, 132.230 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 119.520 - 1.710 |
| R-factor | 0.131 |
| Rwork | 0.129 |
| R-free | 0.15400 |
| Structure solution method | OTHER |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.712 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC (5.3.0002) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 120.000 | 1.730 |
| High resolution limit [Å] | 1.710 | 1.710 |
| Rmerge | 0.070 | 0.290 |
| Number of reflections | 156337 | |
| <I/σ(I)> | 5.5 | 3.5 |
| Completeness [%] | 99.0 | 64.3 |
| Redundancy | 5 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
