5K6K
Zika virus non-structural protein 1 (NS1)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-04-21 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.0332 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 96.160, 130.440, 147.950 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.080 - 1.890 |
R-factor | 0.1498 |
Rwork | 0.149 |
R-free | 0.18890 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4o6d |
RMSD bond length | 0.007 |
RMSD bond angle | 0.838 |
Data scaling software | XSCALE |
Phasing software | PHASER (2.6.0) |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.080 | 1.920 | |
High resolution limit [Å] | 1.890 | 5.130 | 1.890 |
Rmerge | 0.125 | 0.060 | 1.613 |
Number of reflections | 74493 | ||
<I/σ(I)> | 13.22 | 37.29 | 1.33 |
Completeness [%] | 100.0 | 99.8 | 100 |
Redundancy | 13.5 | 13.3 | |
CC(1/2) | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 25% PEG 3350 150 mM NH3SO4 100 mM tris 8.5 |