2D8O
Structure of VIL-thaumatin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2004-03-20 |
| Detector | RIGAKU RAXIS VII |
| Wavelength(s) | 2.2908 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 57.144, 57.144, 151.905 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.410 - 2.380 |
| R-factor | 0.231 |
| Rwork | 0.231 |
| R-free | 0.26200 |
| Structure solution method | SAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.500 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | SHARP |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.450 | 2.580 |
| High resolution limit [Å] | 2.380 | 2.380 |
| Rmerge | 0.080 | 0.146 |
| Number of reflections | 9725 | |
| Completeness [%] | 91.1 | 32.6 |
| Redundancy | 11.4 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.8M K/Na tartrate, 0.1M Na HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
