1XWB
Drospohila thioredoxin, oxidized, P42212
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 42 21 2 |
| Unit cell lengths | 99.465, 99.465, 87.780 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.200 |
| R-factor | 0.22605 |
| Rwork | 0.223 |
| R-free | 0.28835 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1auc |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.083 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.1.19) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.200 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 22855 | |
| <I/σ(I)> | 17.2 | |
| Completeness [%] | 86.8 | 91.5 |
| Redundancy | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 5.2 | 298 | CdCl2, PEG400, pH 5.2, VAPOR DIFFUSION, temperature 298K |
