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Entry information

Complex
AACDB_ID: 4353
PDBID: 7MWW
Chains: HL_E
Organism: Hepacivirus hominis, Mus musculus
Method: XRD
Resolution (Å): 2.71
Reference: 10.1038/s41586-021-03913-5
Antibody
Antibody: 2A12 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: hepatitis C virus envelope full-length glycoprotein 2 (eE2)
Antigen mutation: No
Durg Target: P26660

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>7MWW_H|Chain B[auth H]|2A12 Fab Heavy chain|Mus musculus (10090)
EVQLQQSGAELVKPGASVKLSCTASGFNIKDTYIHWVNQRPEQGLEWIGRIDPANGHTQYDPKFQGKATITADTSSNTAYLQLSSLTSEDTAVYYCATSDYSYALDSWGQGTSVTVSSAKTTAPSVYPLAPVCGDTTGSSVTLGCLVKGYFPEPVTLTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVTSSTWPSQSITCNVAHPASSTKVDKKIEPRGPT

Light Chain: L
Mutation: NULL

>7MWW_L|Chain C[auth L]|2A12 Fab light chain|Mus musculus (10090)
MESQTQVLMFLLLWVSGACADIVMTQSPSSLAMSVGQKVTMSCKSSQSLLNSNNQKNYLAWYQQKPGQSPKLLVYFASTRESGVPDRFIGSGSGTDFTLTISSVQAEDLADYFCQQHYSTPYTFGGGTKLEIRRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC

Antigen

Chain: E
Mutation: NULL

>7MWW_E|Chain A[auth E]|Core protein precursor eE2|Hepacivirus C (3052230)
RTHTVGGSAAQTTGRLTSLFDMGPRQKIQLVNTNGSWHINRTALNCNDSLHTGFIASLFYTHSFNSSGCPERMSACRSIEAFRVGWGALQYEDNVTNPEDMRPYCWHYPPRQCGVVSAKTVCGPVYCFTPSPVVVGTTDRLGAPTYTWGENETDVFLLNSTRPPLGSWFGCTWMNSSGYTKTCGAPPCRTRADFNASTDLLCPTDCFRKHPDTTYLKCGSGPWLTPRCLIDYPYRLWHYPCTVNYTIFKIRMYVGGVEHRLTAACNFTRGDR

Interaction

1、Solvent accessible surface areas (SASA) were calculated (Naccess V2.1.1) for each residue in antibody and antigen, respectively. The residues with SASA loss in binding of more than 1Å2 were classified as interacting residues.

Interacting residues (ΔSASA based)

Chain residues position delta_SASA : residuesposition

H: GLU1 VAL2 GLY26 PHE27 LYS30 ASP31 THR32 TYR33 ASP52 ALA54 THR98 SER99 ASP100 TYR101 ALA104 ASP106

L: LEU52 TYR55 GLU61 SER62

E: ILE630 PHE631 LYS632 ILE633 ARG634 TYR636 VAL640 GLU641 ARG643 LEU644 THR645

2、We defined interacting paratope-epitope residues by a distance cutoff of < 6 Å . Two amino acids are considered as interacting residues if they have at least one atom within a distance of 6 Å from any atom.

Interacting residues (Atom distance based)

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