3D8X
Crystal Structure of Saccharomyces cerevisiae NDPPH Dependent Thioredoxin Reductase 1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-01-20 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.229, 125.004, 60.967 |
| Unit cell angles | 90.00, 114.16, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.800 |
| R-factor | 0.22625 |
| Rwork | 0.226 |
| R-free | 0.23431 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1vdc |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.223 |
| Data reduction software | AUTOMAR |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.800 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Number of reflections | 19676 | |
| <I/σ(I)> | 4 | 1.2 |
| Completeness [%] | 93.4 | 94.8 |
| Redundancy | 3 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 6.5 | 291 | pH 6.5, EVAPORATION, temperature 291K |
