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Entry information

Complex
AACDB_ID: 7491
PDBID: 6OKM
Chains: HL_R
Organism: Homo sapiens
Method: XRD
Resolution (Å): 2.10
Reference: 10.1080/19420862.2019.1625662
Antibody
Antibody: 3C8 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: Tumor necrosis factor receptor superfamily member 4 (TNFRSF4)
Antigen mutation: No
Durg Target:

Sequence information

Antibody

Heavy Chain: H
Mutation: NULL

>6OKM_H|Chain A[auth H]|Fab 3C8 Heavy Chain|Homo sapiens (9606)
EVQLVQSGAEVKKPGASVKVSCKASGYAFTNYLIEWVRQAPGQGLEWIGVINPGSGDTYYSEKFKGRVTLTADTSTSTAYLELSSLRSEDTAVYYCARDRLDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDKTHL

Light Chain: L
Mutation: NULL

>6OKM_L|Chain B[auth L]|Fab 3C8 light chain|Homo sapiens (9606)
DIQMTQSPSSLSASVGDRVTITCHASQDISSYIVWYQQKPGKSFKGLIYHGTNLESGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCVHYAQFPYTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC

Antigen

Chain: R
Mutation: NULL

>6OKM_R|Chain C[auth R]|Tumor necrosis factor receptor superfamily member 4|Homo sapiens (9606)
MGSSHHHHHHSSGLVPRGSHMLHCVGDTYPSNDRCCHECRPGNGMVSRCSRSQNTVCRPCGPGFYNDVVSSKPCKPCTWCNLRSGSERKQLCTATQDTVCRCRAGTQPLDSYKPGVDCAPCPPGHFSPGDNQACKPWTNCTLAGKHTLQPASNSSDAICEDRD

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: THR30 ASN31 TYR32 LEU33 VAL50 ASN52 ASP57 THR58 TYR59 ARG98 ASP99 ARG100 ASP102

L: TYR32 VAL34 TYR49 ASN53 LEU54 GLU55 SER56 GLY57 VAL58 SER60 TYR91 ALA92 GLN93 PHE94 TYR96

R: PRO66 CYS67 GLY68 PRO69 GLY70 PHE71 CYS81 LYS82 PRO83 CYS84 TRP86 CYS87 ASN88 LEU89 ARG90 ARG95 LYS96 GLN97 LEU98 CYS99 THR100

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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