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Entry information

Complex
AACDB_ID: 2110
PDBID: 6CHB
Chains: OP_H
Organism: Human immunodeficiency virus 1, Homo sapiens
Method: XRD
Resolution (Å): 6.80
Reference: 10.1038/s41467-018-03632-y
Antibody
Antibody: IOMA Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: HIV-1 BG505 SOSIP.664 gp120
Antigen mutation: Yes
Durg Target:

Sequence information

Antibody

Heavy Chain: O
Mutation: NULL

>6CHB_O|Chain E[auth D], I[auth M], O|IOMA Heavy Chain|Homo sapiens (9606)
EVQLVESGAQVKKPGASVTVSCTASGYKFTGYHMHWVRQAPGRGLEWMGWINPFRGAVKYPQNFRGRVSMTRDTSMEIFYMELSRLTSDDTAVYYCAREMFDSSADWSPWRGMVAWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDKT

Light Chain: P
Mutation: NULL

>6CHB_P|Chain F[auth E], J[auth N], P|IOMA Light Chain|Homo sapiens (9606)
QSALTQPASVSGSPGQSITISCAGSSRDVGGFDLVSWYQQHPGKAPKLIIYEVNKRPSGISSRFSASKSGNTASLTISGLQEEDEAHYYCYSYADGVAFGGGTKLTVLGQPKAAPSVTLFPPSSEELQANKATLVCLISDFYPGAVTVAWKADSSPVKAGVETTTPSKQSNNKYAASSYLSLTPEQWKSHRSYSCQVTHEGSTVEKTVAPTECS

Antigen

Chain: H
Mutation: A469C

>6CHB_H|Chain B[auth F], H[auth G], N[auth H]|Envelope glycoprotein gp120|Human immunodeficiency virus 1 (11676)
AENLWVTVYYGVPVWKDAETTLFCASDAKAYETEKHNVWATHACVPTDPNPQEIHLENVTEEFNMWKNNMVEQMHTDIISLWDQSLKPCVKLTPLCVTLQCTNVTNNITDDMRGELKNCSFNMTTELRDKKQKVYSLFYRLDVVQINENQGNRSNNSNKEYRLINCNTSAITQACPKVSFEPIPIHYCAPAGFAILKCKDKKFNGTGPCPSVSTVQCTHGIKPVVSTQLLLNGSLAEEEVMIRSENITNNAKNILVQFNTPVQINCTRPNNNTRKSIRIGPGQAFYATGDIIGDIRQAHCNVSKATWNETLGKVVKQLRKHFGNNTIIRFANSSGGDLEVTTHSFNCGGEFFYCNTSGLFNSTWISNTSVQGSNSTGSNDSITLPCRIKQIINMWQRIGQAMYAPPIQGVIRCVSNITGLILTRDGGSTNSTTETFRPGGGDMRDNWRSELYKYKVVKIEPLGVAPTRCKRRVVGREKR

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)

O: LYS28 THR30 HIS33 TRP50 PHE53 ARG54 GLY55 ALA56 VAL57 LYS58 TYR59 PRO60 GLN61 ARG64 MET69 THR70 ARG71 THR73 SER74 MET75 GLU76 GLU95 PHE97

P: TYR91 ASP93 GLY94

H: TRP96 LYS97 ASN99 VAL101 GLU102 ARG192 ASN197 THR198 ASN276 THR278 ASN279 ASN280 ALA281 LYS282 ASN283 ARG360 ALA362 SER365 GLY366 GLY367 ASP368 GLU370 VAL371 LYS421 ASN425 MET426 TRP427 GLN428 ILE430 THR455 ARG456 ASP457 GLY458 GLY459 SER460 ASN462 THR467 ARG469 PRO470 GLY471 GLY472 GLY473 ASP474 MET475 ARG476 ASP477

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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