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Entry information

Complex
AACDB_ID: 549
PDBID: 3JBQ
Chains: hl_B
Organism: Mus musculus, Bos taurus
Method: EM
Resolution (Å): 11.00
Reference: 10.1074/jbc.M115.647636
Antibody
Antibody: 2E8 Fab
Antibody mutation: No
INN (Clinical Trial):
Antigen
Antigen: phosphodiesterase 5/6 chimera catalytic domain
Antigen mutation: No
Durg Target: O76074

Sequence information

Antibody

Heavy Chain: h
Mutation: NULL

>3JBQ_h|Chain B[auth H], J[auth h]|IgG1-kappa 2E8 heavy chain|Mus musculus (10090)
EVQLQQSGAEVVRSGASVKLSCTASGFNIKDYYIHWVKQRPEKGLEWIGWIDEIGDTEYVPKFQGKATMTADTSSNTAYLQLSSLTSEDTAVYYCNAGHDYDRGRFPYWGQGTLVTVSAAKTTPPSVYPLAPGSAAQTNSMVTLGCLVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSETVTCNVAHPASSTKVDKKIVPRD

Light Chain: l
Mutation: NULL

>3JBQ_l|Chain A[auth L], I[auth l]|IgG1-kappa 2E8 light chain|Mus musculus (10090)
DIVMTQSQKFMSTSVGDRVSITCKASQNVGTAVAWYQQKPGQSPKLMIYSASNRYTGVPDRFTGSGSGTDFTLTISNMQSEDLADYFCQQYSSYPLTFGAGTKLELKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSATDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC

Antigen

Chain: B
Mutation: NULL

>3JBQ_B|Chain C[auth B], F|phosphodiesterase 5/6 chimera catalytic domain|Bos taurus (9913)
GSHMEETRELQSLAAAVVPSAQTLKITDFSFSDFELSDLETALCTIRMFTDLNLVQNFQMKHEVLCRWILSVKKNYRKNVAYHNWRHAFNTAQCMFAALKAGKIQNKLTDLEILALLIAALSHDLDHRGVNNSYIQRSEHPLAQLYCHSIMEHHHFDQCLMILNSPGNQILSGLSIEEYKTTLKIIKQAILATDLALYIKRRGEFFELIRKNQFNLEDPHQKELFLAMLMTACDLSAITKPWPIQQRIAELVATEFWEQGDLERTVLQQQPIPMMDRNKRDELPKLQVGFIDFVCTQLYEALTHVSEDCFPLLDGCRKNRQKWQALAEQQ

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: TYR94

h: LYS30 ASP31 TYR33 TRP50 ASP52 GLU53 ILE54 ASP56 GLU58 THR73 ASP97 TYR98

B: THR784 GLU788 ASP791 ARG794 THR795 VAL796 GLN800 PRO801 ASP806 ARG807 ASN808 ARG810

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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