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Entry information

Complex
AACDB_ID: 6697
PDBID: 3U2S
Chains: HL_G
Organism: Homo sapiens, Human immunodeficiency virus 1
Method: XRD
Resolution (Å): 1.80
Reference: 10.1038/nature10696
Antibody
Antibody: PG9 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: HIV-1 ZM109 strain envelope glycoprotein gp120 V1V2 1FD6 scaffold
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>3U2S_H|Chain A, D[auth H]|PG9 heavy chain|Homo sapiens (9606)
QRLVESGGGVVQPGSSLRLSCAASGFDFSRQGMHWVRQAPGQGLEWVAFIKYDGSEKYHADSVWGRLSISRDNSKDTLYLQMNSLRVEDTATYFCVREAGGPDYRNGYNYYDFYDGYYNYHYMDVWGKGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDKGLEVLFQ

Light Chain: L
Mutation: NULL

>3U2S_L|Chain B, E[auth L]|PG9 light chain|Homo sapiens (9606)
QSALTQPASVSGSPGQSITISCQGTSNDVGGYESVSWYQQHPGKAPKVVIYDVSKRPSGVSNRFSGSKSGNTASLTISGLQAEDEGDYYCKSLTSTRRRVFGTGTKLTVLGQPKAAPSVTLFPPSSEELQANKATLVCLISDFYPGAVTVAWKADSSPVKAGVETTTPSKQSNNKYAASSYLSLTPEQWKSHKSYSCQVTHEGSTVEKTVAPTECS

Antigen

Chain: G
Mutation: NULL

>3U2S_G|Chain C, F[auth G]|Envelope glycoprotein gp120|Human immunodeficiency virus 1 (11676)
MTTFKLAACVTLACTSPAAHAESETRVKHCSFNITTDVKDRKQKVNATFYDLDIVPLSSSDASSASSLYRLISCQTTTTEAVDAATAAKVFKQYANDNGIDGEWTYDDATKTFTVTEGLEVLFQ

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)

H: ARG31

G: CYS157 SER158 ASN160 THR162 THR163 LYS166 ASP167 ARG168 LYS169 GLN170 LYS171 ASN173 ASP223 GLY240

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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