Table 3.
Antibody | Epitope region | Length | Overlapping residues with known epitopes | Interaction energy (kcal/mol) | Interaction area (Å2) | ||||
---|---|---|---|---|---|---|---|---|---|
EPIPRED (29 residues) | 7C01 (26 residues) | S2H14 (23 residues) | S2H13 (20 residues) | ACE2 (17 residues) | |||||
C002 | 417,449,453,455,456,473,475,484,485,486,487,488,489,490,493,494,496,498,501,505 | 20 | 11 | 11 | 14 | 10 | 14 | − 17.2 | 855 |
Tremelimumab | 403,406,417,449,453,455,456,484,485,486,487,488,489,493,494,495,496,498,500,501,502,505 | 22 | 8 | 12 | 17 | 9 | 15 | − 15.9 | 848 |
COV2-2015 | 346,444,445,446,447,448,449,450,452,453,484,485,486,490,493,494,496,498,505 | 19 | 4 | 3 | 12 | 12 | 8 | − 12.7 | 827 |
Afasevikumab | 403,444,445,446,447,449,450,453,455,483,484,485,486,490,493,494,496,498,505 | 19 | 6 | 5 | 14 | 13 | 9 | − 14.9 | 923 |
COVA2-29 | 403,405,406,408,409,416,417,446,447,449,453,455,493,494,496,498,500,501,502,503,504,505 | 22 | 2 | 12 | 14 | 6 | 12 | − 15.6 | 934 |
Tremelimumab | 403,406,417,449,453,455,456,484,485,486,487,488,489,493,494,495,496,498,500,501,502,505 | 22 | 8 | 12 | 17 | 9 | 15 | − 15.9 | 848 |
HbnC3t1p1_G4 | 403,405,408,409,416,417,420,421,449,453,455,456,475,484,486,487,489,490,493,494,496,498,500,501,502,504,505 | 27 | 10 | 18 | 16 | 8 | 16 | − 19.9 | 955 |
Ipilimumab | 403,406,417,421,444,446,447,449,453,455,456,484,485,486,487,489,493,496,498,500,501,502,505 | 23 | 9 | 13 | 18 | 10 | 16 | − 13.7 | 1039 |
Epitopes for neutralizing and therapeutic antibodies, which show the highest overlap with known epitope regions are highlighted.