3EXB
Crystal structure of Cytochrome C Peroxidase with a Proposed Electron Pathway Excised in a Complex with a Peptide Wire
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-1 |
| Synchrotron site | SSRL |
| Beamline | BL9-1 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2002-12-15 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.08 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 107.029, 75.070, 50.790 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 10.000 - 1.600 |
| R-factor | 0.169 |
| Rwork | 0.168 |
| R-free | 0.19000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1kxn |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.344 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.1.9) |
| Phasing software | AMoRE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.470 | 1.640 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.074 | 0.302 |
| Total number of observations | 12322 | |
| Number of reflections | 54328 | |
| <I/σ(I)> | 18.4 | 2.5 |
| Completeness [%] | 99.2 | 96.3 |
| Redundancy | 3.4 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6 | 282 | 200 mM KPi, 25% MPD, pH 6.0, VAPOR DIFFUSION, temperature 282K |
