3GNV
HCV NS5B polymerase in complex with 1,5 benzodiazepine inhibitor 1b
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-05-07 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97630 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 106.291, 107.965, 133.799 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 83.330 - 2.750 |
| R-factor | 0.17713 |
| Rwork | 0.174 |
| R-free | 0.23443 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3cso |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.301 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 83.330 | 2.900 |
| High resolution limit [Å] | 2.750 | 2.750 |
| Number of reflections | 38684 | |
| Completeness [%] | 100.0 | 99.99 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.75 | 293 | 5-8% PEG 6000, 100mM Mg-Salts, pH 6.75, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
