2ANZ
cytochrome c peroxidase in complex with 2,6-diaminopyridine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 200 |
Detector technology | IMAGE PLATE |
Collection date | 2005-05-24 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 50.840, 76.170, 107.080 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.330 - 1.750 |
R-factor | 0.192 |
Rwork | 0.192 |
R-free | 0.21000 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1ac4 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.200 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 1.810 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.064 | 0.395 |
Number of reflections | 39610 | |
<I/σ(I)> | 18.3 | 3.5 |
Completeness [%] | 96.9 | 99.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 310 | MES, MPD, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 310K |