3RY8
Structural basis for norovirus inhibition and fucose mimicry by citrate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 293 |
| Detector technology | CCD |
| Collection date | 2010-09-10 |
| Detector | MAR225 CCD |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.763, 79.811, 69.605 |
| Unit cell angles | 90.00, 96.84, 90.00 |
Refinement procedure
| Resolution | 31.975 - 1.400 |
| R-factor | 0.1394 |
| Rwork | 0.139 |
| R-free | 0.15060 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.393 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.450 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.342 | |
| Number of reflections | 136131 | |
| <I/σ(I)> | 3.15 | |
| Completeness [%] | 99.9 | 99.6 |
| Redundancy | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | ammonium citrate (0.66 M) and isopropanol (1.65% v/v), pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
