3EWP
complex of substrate ADP-ribose with IBV Nsp3 ADRP domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-01-12 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 41.364, 43.985, 49.266 |
| Unit cell angles | 78.25, 79.45, 73.39 |
Refinement procedure
| Resolution | 28.550 - 2.000 |
| R-factor | 0.17846 |
| Rwork | 0.176 |
| R-free | 0.22970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.916 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | CCP4 |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.299 | 0.299 |
| Number of reflections | 22223 | |
| <I/σ(I)> | 3.6 | |
| Completeness [%] | 82.3 | 85.2 |
| Redundancy | 3 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 291 | 0.12M Magnesium chloride hexahydrate, 0.1M HEPES pH 7.5, 22% w/v PEG 3350 , VAPOR DIFFUSION, temperature 291.0K |
