Structure of PDB 7jnb Chain A Binding Site BS01

Receptor Information
>7jnb Chain A (length=395) Species: 195103 (Clostridium perfringens ATCC 13124) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GLVPRGSHMSHQARVSKFDLYNSDKLDAYNQEFQVSRSNIKSINNNGGKY
NSSTIDKAIDGNLETHWETGKPNDANFTNEVVVTFNEITNIDRIVYSARR
DSARGKGFAKEFEIYASLKDEGDDFNLVSSGEYTESTRDLVEIKFNPTDF
KRLKFKFKKADQNWASAAEFMFYKEDKLNEKFNGLFTDSSMNKVSEEFNT
LEKLNAFENELKDHPIYDLYKEGLNNARAILTETSENPTKATLGQITYNL
NDDYNNQYRMPYKNIKAIKNNGRHYAAQNIEKAIDNDVNTYWETGTLNSF
NNEVEVEFNDLVTLDRIVYGSRQSDLKGFAEEVYIYASRTSKGDTYKLVA
TGAHEATKGLVEAKFEPTEFKRVKFKFKKSKQNSATLNELMFYKP
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7jnb Chain A Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7jnb Architecturally complex O -glycopeptidases are customized for mucin recognition and hydrolysis.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		K318 D321 D323 T326 N426 E427
Binding residue
(residue number reindexed from 1)		K282 D285 D287 T290 N388 E389
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links