3I43
Escherichia coli Thiol peroxidase (Tpx) wild type disulfide form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU300 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-11-28 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.542 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 38.830, 64.000, 137.950 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.360 - 2.800 |
| R-factor | 0.20029 |
| Rwork | 0.198 |
| R-free | 0.21931 |
| Structure solution method | Difference fourier based on isomorphous starting model |
| Starting model (for MR) | 3hvs |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.5.0046) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.360 | 2.950 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Number of reflections | 7832 | |
| <I/σ(I)> | 7 | 2.1 |
| Completeness [%] | 96.9 | 98 |
| Redundancy | 2.9 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.2 | 277 | 20% (w/v) PEG-8000, 0.1 M phosphate citrate, 0.2 M sodium chloride, pH 4.2, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
