4A7M
cytochrome c peroxidase S81W mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH2R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-02-14 |
| Detector | RIGAKU IMAGE PLATE |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 51.116, 75.117, 107.192 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.770 - 1.710 |
| R-factor | 0.1784 |
| Rwork | 0.177 |
| R-free | 0.20878 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2v23 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.280 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.080 | 1.800 |
| High resolution limit [Å] | 1.710 | 1.710 |
| Rmerge | 0.070 | 0.240 |
| Number of reflections | 43966 | |
| <I/σ(I)> | 14.4 | 4.7 |
| Completeness [%] | 97.9 | 96.2 |
| Redundancy | 2.4 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICRODIALYSIS | 6 | MICRODIALYSIS AGAINST 30% MPD., pH 6.0 |
