8X3V
Crystal structure of 2C from encephalomyocarditis virus bound with ATP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL02U1 |
Synchrotron site | SSRF |
Beamline | BL02U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-11-15 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 0.9788 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 171.000, 171.000, 77.010 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.360 - 2.900 |
R-factor | 0.229 |
Rwork | 0.224 |
R-free | 0.27300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.138 |
Data reduction software | autoPROC |
Data scaling software | autoPROC |
Phasing software | PHASER |
Refinement software | PHENIX ((1.19_4092: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.970 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.186 | 0.952 |
Rmeas | 0.189 | 0.866 |
Number of reflections | 15238 | 1108 |
<I/σ(I)> | 21.2 | 1.9 |
Completeness [%] | 99.9 | 100 |
Redundancy | 38.5 | 38.9 |
CC(1/2) | 0.990 | 0.780 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 30% PEG400, 0.2 M Sodium citrate tribasic, 0.1 M Tris |