Structure of PDB 8jgw Chain A Binding Site BS01

Receptor Information
>8jgw Chain A (length=500) Species: 1392499 (Klebsiella pneumoniae subsp. pneumoniae 1158) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RPQEFAAVDLGSNSFHMVIARVVDGAMQIIGRLKQRVHLADGLDENSVLS
EEAMTRGLNCLSLFAERLQGFSPSSVCIVGTHTLRQATNAAEFLKRAEKV
IPYPIEIISGNEEARLIFMGVEHTQPERGRKLVIDIGGGSTELVIGEDFE
PRLVESRRMGCVSFSQAYFPGGVINKENFQRARLAAVQKLETLAWQFRIQ
GWTVALGASGTIKAAQEVLVAMGEKDGFITPERLEMLVSELLKHKNFDAL
SLPGLSEDRKAVFAPGLAILCGVFDALAIKELRLSDGALREGVLYEMEGR
FRHQDIRSRTAQSLANQYNIDREQARRVLETTTQMLEQWQEQNPKLANPH
LAALLKWAVMLHEVGLNINHSGMHRHSAYILQNSDLPGFNQEQQMLMATL
VRYHRKAIKLDDLPRFTLFRKKQFLPLIQLLRLGVLLNNQRQATTTPPTL
RLQTEAHHWTLTFPHNWFSQNALVLLDLEKEQQYWEGVPEWMLKIAEEEP
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 chain8jgw Chain A Residue 609 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8jgw Structural Evolution of Bacterial Polyphosphate Degradation Enzyme for Phosphorus Cycling.
Resolution1.8 Å
Binding residue
(original residue number in PDB)		L394 F397
Binding residue
(residue number reindexed from 1)		L386 F389
Annotation score1
Gene Ontology
Molecular Function
GO:0004309 exopolyphosphatase activity
GO:0016787 hydrolase activity
Biological Process
GO:0006793 phosphorus metabolic process
GO:0006798 polyphosphate catabolic process
Cellular Component
GO:0005886 plasma membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:8jgw, PDBe:8jgw, PDBj:8jgw
PDBsum8jgw
PubMed38682481
UniProtA0A171A1Q0

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