5GVU
crystal structure of BVDV NS3 helicase domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-05-22 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 32 |
| Unit cell lengths | 121.100, 121.100, 109.721 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 50.010 - 2.820 |
| R-factor | 0.2732 |
| Rwork | 0.272 |
| R-free | 0.29840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4cbg |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.361 |
| Data scaling software | SCALA (3.3.22) |
| Phasing software | PHASER (2.5.7) |
| Refinement software | REFMAC (5.8.0124) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.010 | 48.608 | 2.970 |
| High resolution limit [Å] | 2.820 | 8.920 | 2.820 |
| Rmerge | 0.089 | 0.451 | |
| Number of reflections | 41208 | ||
| <I/σ(I)> | 17.3 | 7.3 | 1.6 |
| Completeness [%] | 100.0 | 98.8 | 100 |
| Redundancy | 15 | 14.3 | 15.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M sodium formate, 15% w/v PEG 3350 |
