4X2X
Crystal structure of the Murine Norovirus NS6 protease (inactive C139A mutant) with a C-terminal extension to include residues P1 prime - P4 prime of NS7
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-04-22 |
| Detector | RIGAKU SATURN 944+ |
| Wavelength(s) | 1.54 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 88.190, 35.360, 52.810 |
| Unit cell angles | 90.00, 105.98, 90.00 |
Refinement procedure
| Resolution | 38.108 - 2.472 |
| R-factor | 0.2108 |
| Rwork | 0.208 |
| R-free | 0.25240 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ash |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.083 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.110 | 38.110 |
| High resolution limit [Å] | 2.472 | 2.472 |
| Rmerge | 0.034 | 0.106 |
| Number of reflections | 5711 | |
| <I/σ(I)> | 19.63 | 6.94 |
| Completeness [%] | 99.0 | 92.44 |
| Redundancy | 3 | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | 0.2 M KSCN, 0.1 M Bis-Tris propane pH 6.5-7.5, 20% w/v PEG 3350, cryo 30% (v/v) PEG 3350 |
