5CID
Complex of yeast cytochrome c peroxidase (W191G) bound to o-toluidine with iso-1 cytochrome c
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE A1 |
Synchrotron site | CHESS |
Beamline | A1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-05-23 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.9778 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.380, 111.906, 87.894 |
Unit cell angles | 90.00, 104.33, 90.00 |
Refinement procedure
Resolution | 42.580 - 2.763 |
R-factor | 0.2197 |
Rwork | 0.214 |
R-free | 0.26820 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.879 |
Data scaling software | HKL-2000 |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.800 |
High resolution limit [Å] | 2.750 | 7.460 | 2.750 |
Rmerge | 0.092 | 0.042 | 0.388 |
Total number of observations | 109129 | ||
Number of reflections | 20376 | ||
<I/σ(I)> | 7.7 | ||
Completeness [%] | 93.5 | 99.8 | 65.7 |
Redundancy | 5.4 | 5.5 | 4.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | PEG 3350 15-15%, 100 mM NaAcetate, 175 mM NaCl |