Details

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Entry information

Complex
AACDB_ID: 4751
PDBID: 7RDW
Chains: GI_N
Organism: Human immunodeficiency virus 1, Homo sapiens
Method: XRD
Resolution (Å): 3.55
Reference: 10.1126/sciadv.abm3948
Antibody
Antibody: FH1 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: HIV-1 HxB2 gp120 core
Antigen mutation: No
Durg Target: P12488; P35961;

Sequence information

Antibody

Heavy Chain: G
Mutation: NULL

>7RDW_G|Chain C[auth G], K[auth U]|FH1 Fab Heavy Chain|Homo sapiens (9606)
QVQLVQSGAEVKKPGASVKVSCKASGYTFTGYYMNWVRQAPGQGLEWMGWINPNSGDTNYAQKFQGRVTMTRDTSSSTAYMELNRVRSDDTAVYYCARWDWGQYWFFDLWGRGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDK

Light Chain: I
Mutation: NULL

>7RDW_I|Chain E[auth I], F[auth L], J[auth R], L[auth V]|FH1 Fab Light Chain|Homo sapiens (9606)
EIVLTQSPGTLSLSPGERATLSCRASQSVRSSYLAWYQQKPGQVPRLLIYGASSRATGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQHMYTFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC

Antigen

Chain: N
Mutation: NULL

>7RDW_N|Chain A[auth C], B[auth D], G[auth M], H[auth N]|Glycoprotein 120|Human immunodeficiency virus 1 (11676)
VWKEATTTLFCASDAKAYDTECHNVWATHACVPTDPNPQEVVLVNVTENFNMWKNDMVEQMHEDIISLWDQCLKPCVKLTNTSVITQACPKVSFEPIPIHYCAPAGFAILKCNNKTFNGTGPCTNVSTVQCTHGIRPVVSTQLLLNGSLAEEEVVIRSVNFTDNAKTIIVQLNTSVEINCTRPNNGGSGSGGNMRQAHCNISRAKWNNTLKQIASKLREQFGNNKTIIFKQSSGGDPEIVTHSFNCGGEFFYCNSTQLFNSTWFNSTWSTEGSNNTEGSDTITLPCRIKQIINMWQKVGKAMYAPPISGQIRCSSNITGLLLTRDGGNSNNESEIFRPGGGDMRDNWRSELYKYKVVKIEPLGSGSGHHHHHH

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)

G: THR30 GLY31 TYR32 TYR33 TRP47 TRP50 ASN53 ASP56 THR57 ASN58 TYR59 ALA60 GLN61 GLN64 TRP95 TRP97 GLN99

I: GLU1 ILE2 VAL28 ARG29 TYR32 HIS90 MET91 TYR96 THR97

N: THR51 LEU52 PHE53 CYS54 ALA55 ASP57 ALA58 LYS59 ALA60 TYR61 THR63 VAL68 TRP69 THR71 HIS72 ALA73 CYS74 VAL75 PRO76 THR77 ASP78 PRO79 ASN80 GLN82 ASP107 SER110 GLN114 PRO220 ALA221 GLN246 CYS247

2、We defined interacting paratope-epitope residues by a distance cutoff of < 5Å . Two amino acids are considered as interacting residues if they have at least one atom within a distance of 5 Å from any atom.

Interacting residues (Atom distance based)

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