4JJU
Crystal structure of HCV NS5B polymerase in complex with COMPOUND 29
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 110 |
Detector technology | PIXEL |
Collection date | 2008-08-27 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.91 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 107.070, 108.390, 134.880 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.910 |
Rwork | 0.192 |
R-free | 0.21500 |
Structure solution method | PDB ENTRY 3MWV |
RMSD bond length | 0.005 |
RMSD bond angle | 1.195 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | CNX |
Refinement software | CNX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.020 |
High resolution limit [Å] | 1.910 | 1.910 |
Rmerge | 0.085 | 0.356 |
Number of reflections | 121688 | |
<I/σ(I)> | 18.03 | 3.86 |
Completeness [%] | 99.2 | 95.6 |
Redundancy | 6.54 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.4 | 100 mM MES, 21% PEGmme 5000, 400 mM Ammonium sulfate, 10% glycerol, pH 5.4, VAPOR DIFFUSION, HANGING DROP, temperature 262K |