4KHM
HCV NS5B GT1A with GSK5852
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-08-17 |
Detector | RAYONIX MX225HE |
Spacegroup name | P 1 |
Unit cell lengths | 53.030, 61.111, 91.682 |
Unit cell angles | 89.63, 87.06, 80.91 |
Refinement procedure
Resolution | 29.190 - 1.700 |
R-factor | 0.193 |
Rwork | 0.192 |
R-free | 0.20700 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.949 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.720 |
High resolution limit [Å] | 1.660 | 1.660 |
Rmerge | 0.088 | 0.587 |
Number of reflections | 130250 | |
<I/σ(I)> | 6.4 | |
Completeness [%] | 97.3 | 95.7 |
Redundancy | 4 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5 | 298 | 0.1M Hepes pH7.5, 14% PEG6000, 0.2M ammonium sulfate, 10% glycerol, pH 5.0, vapor diffusion, hanging drop, temperature 298K |