8CNX
Structure of Enterovirus D68 3C protease
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-01-20 |
Detector | DECTRIS EIGER2 X 9M |
Wavelength(s) | 0.9212 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 42.820, 62.530, 147.360 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.627 - 1.490 |
Rwork | 0.204 |
R-free | 0.21990 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.581 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0352) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.630 | 1.530 |
High resolution limit [Å] | 1.490 | 1.490 |
Rmerge | 0.099 | |
Number of reflections | 60463 | 11079 |
<I/σ(I)> | 11.4 | 0.7 |
Completeness [%] | 91.9 | 56.7 |
Redundancy | 10.5 | 4.1 |
CC(1/2) | 0.998 | 0.388 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.14 | 293 | 25% PEG 3,350 0.1 M Tris 0.2 M Ammonium acetate |