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Entry information

Complex
AACDB_ID: 1470
PDBID: 5JSA
Chains: EF_D
Organism: Homo sapiens, Human immunodeficiency virus 1
Method: XRD
Resolution (Å): 6.31
Reference: 10.1038/ncomms12040
Antibody
Antibody: 8ANC195 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: HIV-1 BG505 SOSIP.664 gp41
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Heavy Chain: E
Mutation: NULL

>5JSA_E|Chain E|broadly neutralizing antibody 8ANC195 heavy chain|Homo sapiens (9606)
QIHLVQSGTEVKKPGSSVTVSCKAYGVNTFGLYAVNWVRQAPGQSLEYIGQIWRWKSSASHHFRGRVLISAVDLTGSSPPISSLEIKNLTSDDTAVYFCTTTSTYDKWSGLHHDGVMAFSSWGQGTLISVSAASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDKT

Light Chain: F
Mutation: NULL

>5JSA_F|Chain F|broadly neutralizing antibody 8ANC195 light chain|Homo sapiens (9606)
DIQMTQSPSTLSASIGDTVRISCRASQSITGNWVAWYQQRPGKAPRLLIYRGAALLGGVPSRFSGSAAGTDFTLTIGNLQAEDFGTFYCQQYDTYPGTFGQGTKVEVKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC

Antigen

Chain: D
Mutation: NULL

>5JSA_D|Chain D|gp41|Human immunodeficiency virus 1 (11676)
AVGIGAVFLGFLGAAGSTMGAASMTLTVQARNLLSGEDFTIDIPDVTVWGIKQLQARVLAVERYLRDQQLLGIWGCSGKLICCTNVPWNSSWSNRNLSEIWDNMTWLQWDKEISNYTQIIYGLLEESQNQQEKNEQDLLALD

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)

Chain residues position delta_SASA : residuesposition

E: LYS107 TRP108 SER109 HIS112 HIS113 ASP114

F: SER28 GLY30 ASN31 TRP32 ARG50 GLY68 ASP92

D: SER602 SER604 ASN605 ARG606 LEU618 GLN619 ASP621 LYS622 GLU623 SER625 ASN626 TYR627

2、We defined interacting paratope-epitope residues by a distance cutoff of < 6 Å . Two amino acids are considered as interacting residues if they have at least one atom within a distance of 6 Å from any atom.

Interacting residues (Atom distance based)

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