5YVU
Crystal structures of unlinked full length NS3 from Dengue virus provide insights into dynamics of protease domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-02-22 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 53.059, 85.627, 85.508 |
| Unit cell angles | 90.00, 97.95, 90.00 |
Refinement procedure
| Resolution | 47.704 - 2.491 |
| R-factor | 0.2241 |
| Rwork | 0.222 |
| R-free | 0.26590 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2vbc |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.646 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.700 | 2.580 |
| High resolution limit [Å] | 2.491 | 2.491 |
| Rmerge | 0.118 | 0.545 |
| Rmeas | 0.139 | 0.139 |
| Number of reflections | 50500 | 2458 |
| <I/σ(I)> | 14.03 | 1.87 |
| Completeness [%] | 94.8 | 92.82 |
| Redundancy | 3.4 | 3.2 |
| CC(1/2) | 0.917 | 0.799 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 291 | 0.1M MES pH 6.4, 12% PEG6000 |
