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Entry information

Complex
AACDB_ID: 1365
PDBID: 5FYL
Chains: DE_B
Organism: Human immunodeficiency virus 1, Homo sapiens
Method: XRD
Resolution (Å): 3.10
Reference: 10.1016/j.cell.2016.04.010
Antibody
Antibody: 35O22 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: HIV-1 clade A BG505 SOSIP.664 gp120
Antigen mutation: Yes
Durg Target:

Sequence information

Antibody

Heavy Chain: D
Mutation: NULL

>5FYL_D|Chain B[auth D]|35O22 ANTIBODY FAB HEAVY CHAIN|HOMO SAPIENS (9606)
QGQLVQSGAELKKPGASVKISCKTSGYRFNFYHINWIRQTAGRGPEWMGWISPYSGDKNLAPAFQDRVIMTTDTEVPVTSFTSTGAAYMEIRNLKFDDTGTYFCAKGLLRDGSSTWLPYLWGQGTLLTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDKGLEVLFQ

Light Chain: E
Mutation: NULL

>5FYL_E|Chain C[auth E]|35O22 ANTIBODY FAB LIGHT CHAIN|HOMO SAPIENS (9606)
QSVLTQSASVSGSLGQSVTISCTGPNSVCCSHKSISWYQWPPGRAPTLIIYEDNERAPGISPRFSGYKSYWSAYLTISDLRPEDETTYYCCSYTHNSGCVFGTGTKVSVLGQSKANPSVTLFPPSSEELQANKATLVCLISDFYPGAVTVAWKADSSPVKAGVETTTPSKQSNNKYAASSYLSLTPEQWKSHRSYSCQVTHEGSTVEKTVAPTECS

Antigen

Chain: B
Mutation: I48P/T94C

>5FYL_B|Chain A[auth B]|BG505 GP120 ENV ECTODOMAIN|HUMAN IMMUNODEFICIENCY VIRUS 1 (11676)
AVGIGAVFLGFLGAAGSTMGAASMTLTVQARNLLSGIVQQQSNLLRAPEAQQHLLKLTVWGIKQLQARVLAVERYLRDQQLLGIWGCSGKLICCTNVPWNSSWSNRNLSEIWDNMTWLQWDKEISNYTQIIYGLLEESQNQQEKNEQDLLALD

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

D: GLN1 PHE31 TYR32 PHE72 LEU97 ARG98 ASP99

E: TYR49 GLU50 GLU53 ARG54 PRO56

B: GLY527 THR529 ALA532 ARG617 ASN618 SER620 GLU621 ASP624 ASN625 THR627 LEU629 GLN630 LYS633

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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