2XJ8
The structure of ferrous cytochrome c peroxidase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 51.053, 75.193, 106.950 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.150 - 1.690 |
| R-factor | 0.17686 |
| Rwork | 0.175 |
| R-free | 0.21000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2v2e |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.994 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (CCP4) |
| Phasing software | CCP4 |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.160 | 1.780 |
| High resolution limit [Å] | 1.690 | 1.690 |
| Rmerge | 0.060 | 0.260 |
| Number of reflections | 46761 | |
| <I/σ(I)> | 15.8 | 4 |
| Completeness [%] | 99.4 | 97.2 |
| Redundancy | 5.1 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | pH 6.5 |
