Structure of PDB 7cjg Chain A Binding Site BS02

Receptor Information
>7cjg Chain A (length=289) Species: 242619 (Porphyromonas gingivalis W83) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ADLFSADSAYTFVQRQVNFGPRIPGTAPHRACGDWLVATLRSFGAAVQEQ
TAEIKAHDGTMLPMRNIIASYRPEATGRMLLMAHWDTRPVCDQDANPAMH
TETFDGADDGGSGVGVLLEIARYLGQQKDLGMGIDIVFFDTEDYGSYGDD
ESWCLGSQYWSRNPHVAGYKAEAGILLDMVGAKGATFYWEYFSKSYAPGL
ISAVWQTAAALGYGNYFIQADGGALTDDHVPVIKNLGIPCIDIINYSSKN
EHGFGDHWHTQRDNMQIIDKNVLDAVGETVIRYLDEQVK
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain7cjg Chain A Residue 405 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7cjg Structural and kinetic characterization of Porphyromonas gingivalis glutaminyl cyclase.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		D42 F44 D314 E318
Binding residue
(residue number reindexed from 1)		D2 F4 D274 E278
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008270 zinc ion binding
GO:0016603 glutaminyl-peptide cyclotransferase activity
GO:0016746 acyltransferase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:7cjg, PDBe:7cjg, PDBj:7cjg
PDBsum7cjg
PubMed33823093
UniProtQ7MT37

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