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Entry information

Complex
AACDB_ID: 2108
PDBID: 6CHB
Chains: DE_G
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: D
Mutation: NULL

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

Light Chain: E
Mutation: NULL

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

Antigen

Chain: G
Mutation: A469C

>6CHB_G|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)

D: LYS28 PHE29 THR30 HIS33 TRP50 ILE51 PHE53 ARG54 GLY55 ALA56 VAL57 LYS58 TYR59 GLN61 ARG64 MET69 THR70 ARG71 THR73 SER74 MET75

E: PHE30 TYR91 ALA92 ASP93 GLY94

G: TRP96 LYS97 GLU102 HIS105 ASN197 THR198 THR278 ASN279 ASN280 ALA281 LYS282 ASN283 PHE353 ARG360 SER364 SER365 GLY366 GLY367 ASP368 GLU370 VAL371 ASN425 MET426 GLN428 ILE430 THR455 ARG456 ASP457 GLY458 GLY459 SER460 ASN462 THR467 ARG469 GLY471 GLY472 GLY473 ASP474 ARG476 ASP477 ARG480

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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