5JRZ
Structure of the NS3 helicase from the French Polynesia strain of the Zika virus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-04-26 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97981 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 52.304, 71.864, 59.281 |
| Unit cell angles | 90.00, 94.60, 90.00 |
Refinement procedure
| Resolution | 35.446 - 1.620 |
| R-factor | 0.162 |
| Rwork | 0.161 |
| R-free | 0.19310 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2jlu |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.759 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | Auto-Rickshaw |
| Refinement software | PHENIX ((1.10.1_2155)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.650 |
| High resolution limit [Å] | 1.620 | 4.400 | 1.620 |
| Rmerge | 0.093 | 0.054 | 0.830 |
| Rmeas | 0.107 | 0.062 | 0.969 |
| Rpim | 0.052 | 0.030 | 0.493 |
| Total number of observations | 224045 | ||
| Number of reflections | 56414 | ||
| <I/σ(I)> | 14.9 | ||
| Completeness [%] | 99.7 | 95.6 | 99.3 |
| Redundancy | 4 | 4 | 3.6 |
| CC(1/2) | 0.995 | 0.605 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | PEG8K, MOPS buffer, 200 mM magnesium acetate |
