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Entry information

Complex
AACDB_ID: 1185
PDBID: 5ACO
Chains: JG_C
Organism: Human immunodeficiency virus 1, Homo sapiens
Method: EM
Resolution (Å): 4.36
Reference: 10.1016/j.str.2015.07.020
Antibody
Antibody: PGT128 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: BG505 SOSIP.664 ENVELOPE GLYCOPROTEIN
Antigen mutation: Yes
Durg Target:

Sequence information

Antibody

Heavy Chain: J
Mutation: NULL

>5ACO_J|Chain J, K, L|PGT128 FAB|HOMO SAPIENS (9606)
ESALTQPPSASGSPGQSITISCTGTSNNFVSWYQQHAGKAPKLVIYDVNKRPSGVPDRFSGSKSGNTASLTVSGLQTDDEAVYYCGSLVGNWDVIFGGGTKLTVLGQPKAAPSVTLFPPSSEELQANKATLVCLISDFYPGAVTVAWKADSSPVKAGVETTTPSKQSNNKYAASSYLSLTPEQWKSHRSYSCQVTHEGSTVEKTVAPTECS

Light Chain: G
Mutation: NULL

>5ACO_G|Chain G, H, I|PGT128 FAB|HOMO SAPIENS (9606)
EPQLQESGPTLVEASETLSLTCAVSGDSTAACNSFWGWVRQPPGKGLEWVGSLSHCASYWNRGWTYHNPSLKSRLTLALDTPKNLVFLKLNSVTAADTATYYCARFGGEVLRYTDWPKPAWVDLWGRGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCD

Antigen

Chain: C
Mutation: T301N/A469C

>5ACO_C|Chain A, C, D|HIV-1 ENVELOPE GLYCOPROTEIN|HUMAN IMMUNODEFICIENCY VIRUS 1 (11676)
AENLWVTVYYGVPVWKDAETTLFCASDAKAYETEKHNVWATHACVPTDPNPQEIHLENVTEEFNMWKNNMVEQMHTDIISLWDQSLKPCVKLTPLCVTLQCTNVTNNITDDMRGELKNCSFNMTTELRDKKQKVYSLFYRLDVVQINENQGNRSNNSNKEYRLINCNTSAITQACPKVSFEPIPIHYCAPAGFAILKCKDKKFNGTGPCPSVSTVQCTHGIKPVVSTQLLLNGSLAEEEVMIRSENITNNAKNILVQFNTPVQINCTRPNNNTRKSIRIGPGQAFYATGDIIGDIRQAHCNVSKATWNETLGKVVKQLRKHFGNNTIIRFANSSGGDLEVTTHSFNCGGEFFYCNTSGLFNSTWISNTSVQGSNSTGSNDSITLPCRIKQIINMWQRIGQAMYAPPIQGVIRCVSNITGLILTRDGGSTNSTTETFRPGGGDMRDNWRSELYKYKVVKIEPLGVAPTRCKRRVVGR

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: CYS32 CYS56 ALA57 SER58 TYR59 TRP60 GLU109 LEU111 ARG112 TYR113 THR114 ASP115

C: VAL104 THR105 ASN107 THR267 PRO269 ASN271 ASP290 ILE291 ILE292 GLY293 ASP294 ILE295 ARG296 VAL410 ARG412

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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