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. 2021 May 13;11:10220. doi: 10.1038/s41598-021-89621-6

Table 3.

Summary of epitope regions, interaction energy and interface area for selected conformation of neutralizing and therapeutic antibodies bound with SARS-CoV-2 spike protein.

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.