4JB4
Expression, Purification, Characterization, and Solution NMR Study of Highly Deuterated Yeast Cytochrome c Peroxidase with Enhanced Solubility
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 200 |
Detector technology | CCD |
Collection date | 2011-05-04 |
Detector | RIGAKU SATURN 944+ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.052, 87.920, 87.526 |
Unit cell angles | 90.00, 105.14, 90.00 |
Refinement procedure
Resolution | 43.570 - 2.390 |
R-factor | 0.2156 |
Rwork | 0.212 |
R-free | 0.27937 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1zby |
RMSD bond length | 0.018 |
RMSD bond angle | 1.663 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.450 |
High resolution limit [Å] | 2.390 | 2.390 |
Rmerge | 0.158 | |
Completeness [%] | 99.0 | 90.17 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | 0.2M NH4Cl, 0.1 M CH3COONa pH5.0 and 20% w/v PEG 6000, VAPOR DIFFUSION, HANGING DROP, temperature 298K |