7JRE
Crystal structure of EV-D68 2A protease C107A mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS-II BEAMLINE 17-ID-2 |
Synchrotron site | NSLS-II |
Beamline | 17-ID-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-12-09 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97933 |
Spacegroup name | P 4 |
Unit cell lengths | 118.772, 118.772, 80.380 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.760 - 2.500 |
R-factor | 0.226 |
Rwork | 0.219 |
R-free | 0.23920 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2hrv |
RMSD bond length | 0.006 |
RMSD bond angle | 0.772 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | BALBES |
Refinement software | BUSTER |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.760 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.044 | 0.213 |
Rmeas | 0.062 | 0.302 |
Rpim | 0.044 | 0.213 |
Number of reflections | 38883 | 3875 |
<I/σ(I)> | 21 | 3.8 |
Completeness [%] | 100.0 | 100 |
Redundancy | 2 | |
CC(1/2) | 0.994 | 0.835 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293.15 | 0.05 M Sodium Cacodylate, 10% (v/v) 2-Propanol, 0.005 M Magnesium Chloride, 0.005 M Spermine |