2HXK
Crystal structure of S-nitroso thioredoxin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU300 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2006-03-08 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 116.350, 25.740, 86.020 |
| Unit cell angles | 90.00, 98.20, 90.00 |
Refinement procedure
| Resolution | 24.200 - 1.650 |
| R-factor | 0.19714 |
| Rwork | 0.195 |
| R-free | 0.23919 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ert |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.861 |
| Data reduction software | CrystalClear ((MSC/RIGAKU)) |
| Data scaling software | CrystalClear ((MSC/RIGAKU)) |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.200 | 1.710 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.040 | 0.140 |
| Number of reflections | 29229 | |
| <I/σ(I)> | 16.1 | 3.6 |
| Completeness [%] | 99.0 | 99.9 |
| Redundancy | 2.7 | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 32% PEG 1500, 50 mM sodium phosphate, ethanol, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
