5GSW
Crystal structure of EV71 3C in complex with N69S 1.8k
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | Cu FINE FOCUS |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-05-08 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 94.501, 70.535, 94.923 |
Unit cell angles | 90.00, 118.23, 90.00 |
Refinement procedure
Resolution | 48.620 - 3.190 |
R-factor | 0.197 |
Rwork | 0.189 |
R-free | 0.26800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3osy |
RMSD bond length | 0.012 |
RMSD bond angle | 1.622 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 8.670 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.157 | 0.581 |
Number of reflections | 17983 | |
<I/σ(I)> | 7.36 | |
Completeness [%] | 96.8 | |
Redundancy | 1.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.7 | 289 | 0.1 M Tris-HCl, pH 7.7, 200 mM Sodium Citrate, 16% PEG 3350. |