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Entry information

Complex
AACDB_ID: 2101
PDBID: 6CE0
Chains: HL_G
Organism: Human immunodeficiency virus 1, Homo sapiens
Method: XRD
Resolution (Å): 4.60
Reference: 10.1126/sciadv.aau6769
Antibody
Antibody: PGT124 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: HIV-1 clade B tier-3 isolate H078.14 UFO-BG gp160
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>6CE0_H|Chain E[auth H]|PGT124 Heavy chain|Homo sapiens (9606)
QVQLQESGPGLVRPSETLSVTCIVSGGSISNYYWTWIRQSPGKGLEWIGYISDRETTTYNPSLNSRAVISRDTSKNQLSLQLRSVTTADTAIYFCATARRGQRIYGVVSFGEFFYYYYMDVWGKGTAVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCD

Light Chain: L
Mutation: NULL

>6CE0_L|Chain F[auth L]|PGT124 Light chain|Homo sapiens (9606)
SYVSPLSVALGETARISCGRQALGSRAVQWYQHKPGQAPILLIYNNQDRPSGIPERFSGTPDINFGTTATLTISGVEVGDEADYYCHMWDSRSGFSWSFGGATRLTVLSQPKAAPSVTLFPPSSEELQANKATLVCLISDFYPGAVTVAWKADSSPVKAGVETTTPSKQSNNKYAASSYLSLTPEQWKSHKSYSCQVTHEGSTVEKTVAPTECS

Antigen

Chain: G
Mutation: NULL

>6CE0_G|Chain B[auth G]|Envelope glycoprotein gp160|Human immunodeficiency virus 1 (11676)
AEKLWVTVYYGVPVWKEATTTLFCASDAKAYDTEVHNVWATHACVPTDPNPQEVLLENVTEEFNMWKNSMVEQMHEDIISLWDQSLKPCVKLTPFCVTLNCTNYNGTNGNTTVTNNSTGDGDIKQCSFNITTEIEDKDGSKRRNESALFSKLDLEPINNSNTSYRLIKCNTSVIKQACPKVSFEPIPIHYCAPAGFAILKCNDKRFNGTGPCKNVSTVQCTHGIKPVVSTQLLLNGSLAEEEVVIRSENLTNNAKNIIIQLNESVVITCERPNNNTRKRVTLGPGKVLYTTGEIIGNIRKAHCNISKTNWTRTLERIVIKLREQFKNKTIVFNQSSGGDLEIVMHVFNCGGEFFYCNTTQLFNSTYNSTWNYNSTRNTTDSIITLPCRIKQIINRWQEVGKAMYAPPIAGQIRCQSNITGLILTRDGGGNGTNGTEVFRPAGGDMKDNWRSELYKYKVVRIEPLGIAPTKCKRRVVGGGGGSGGGGS

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)

L: LEU28 GLY29 SER30 ASN66 SER93 ARG94

G: TYR134 GLY324 ASN325 ILE326 ARG327 LYS328 ALA329 HIS330 THR415 PRO417 GLN442

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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