1S6V
Structure of a cytochrome c peroxidase-cytochrome c site specific cross-link
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL7-1 |
Synchrotron site | SSRL |
Beamline | BL7-1 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2003-03-24 |
Detector | MARRESEARCH |
Wavelength(s) | 1.08 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.240, 107.920, 88.380 |
Unit cell angles | 90.00, 104.42, 90.00 |
Refinement procedure
Resolution | 45.650 - 1.880 |
R-factor | 0.19 |
Rwork | 0.190 |
R-free | 0.24300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 1.600 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.910 |
High resolution limit [Å] | 1.880 | 1.880 |
Rmerge | 0.054 | 0.573 |
Number of reflections | 60567 | |
<I/σ(I)> | 13.3 | 3 |
Completeness [%] | 91.9 | 85.9 |
Redundancy | 4 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | PEG 3350, KI, VAPOR DIFFUSION, SITTING DROP, temperature 298K |