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Entry information

Complex
AACDB_ID: 4983
PDBID: 7T7B
Chains: HL_A
Organism: Severe acute respiratory syndrome coronavirus 2, Homo sapiens
Method: XRD
Resolution (Å): 2.59
Reference: 10.1038/s42003-022-03700-6
Antibody
Antibody: ADI-62113 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: SARS-CoV-2 spike glycoprotein RBD
Antigen mutation: No
Durg Target: P0DTC2

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>7T7B_H|Chain B[auth H]|ADI-62113 Fab heavy chain|Homo sapiens (9606)
QVQLQQSGAEVKKPGASVKLSCKASGYTFSVFPIHWVRQAPGQRLEWMGWHNAGDGDTKYSQKFQGRVTIISDTSASTAYMELSSLKSEDTAVYYCARAARPYYDRRGYFFRADYFQHWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSC

Light Chain: L
Mutation: NULL

>7T7B_L|Chain C[auth L]|ADI-62113 Fab light chain|Homo sapiens (9606)
DIQVTQSPSSLSASVGDRVTITCQASQDIKNSLNWYQQKPGKAPKLLISDASNLETGVPSRFSGNGSGTDFTFTISSLQPEDIATYYCQQYDNLITFGPGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGECS

Antigen

Chain: A
Mutation: NULL

>7T7B_A|Chain A|Spike protein S1|Severe acute respiratory syndrome coronavirus 2 (2697049)
TNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQIAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCYFPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSGHHHHHH

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: TYR27 THR28 VAL31 PHE32 ARG94 ALA96 ARG97 PRO98 TYR99 GLN101 HIS102

L: SER49 ASP50 ASN53 GLU55 THR56

A: TYR369 ASN370 SER371 ALA372 PHE374 PHE377 LYS378 CYS379 TYR380 GLY381 VAL382 SER383 PRO384 THR385 ARG408 GLN409 PRO412 GLY413 GLN414 THR415 GLY416 ASP427 ASP428 PHE429

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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