Structure of PDB 7jnf Chain A Binding Site BS01

Receptor Information
>7jnf Chain A (length=398) Species: 195103 (Clostridium perfringens ATCC 13124) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GLVPRGSHMASHQARVSKFDLYNSDKLDAYNQEFQVSRSNIKSINNNGGK
YNSSTIDKAIDGNLETHWETGKPNDANFTNEVVVTFNEITNIDRIVYSAR
RDSARGKGFAKEFEIYASLKDEGDDFNLVSSGEYTESTRDLVEIKFNPTD
FKRLKFKFKKADQNWASAAEFMFYKEDKLNEKFNGLFTDSSMNKVSEEFN
TLEKLNAFENELKDHPIYDLYKEGLNNARAILTETSENPTKATLGQITYN
LNDDYNNQYRMPYKNIKAIKNNGRHYAAQNIEKAIDNDVNTYWETGTLNS
SSFNNEVEVEFNDLVTLDRIVYGSRQSDLKGFAEEVYIYASRTSKGDTYK
LVATGAHEATKGLVEAKFEPTEFKRVKFKFKKSKQNSATLNELMFYKP
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 chain7jnf Chain A Residue 502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB7jnf Architecturally complex O -glycopeptidases are customized for mucin recognition and hydrolysis.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		K93 D96 N98 T101 A204 E205
Binding residue
(residue number reindexed from 1)		K58 D61 N63 T66 A169 E170
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links