Structure of PDB 6vpb Chain B Binding Site BS01

Receptor Information
>6vpb Chain B (length=324) Species: 272568 (Gluconacetobacter diazotrophicus PA1 5) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MQIGIIGLGRMGGNIAVRLSRHGHDVVLFDRDAATVSKVSERIEGGRGVA
ATSLPDLVAKLTAKRKIVWVMLPCGEITENAVQELYGLLGKDDIVIDGGN
TYYKDDIRRAAQLADKGIHYVDVGTSGGVWGLERGYCMMYGGTKDSTDHI
DPILDALAPGKGDVAPTPDRGKPGLDPRAEKGYLHCGPAGSGHFVKMVHN
GIEYGMMQAFAEGFDIMKSKNSPKLPEDQRFDLNMADIAEVWRRGSVVSS
WLLDLTAEALAKNASLSEFTGEVADSGEGRWTLEAAIEEAVPAPVITASL
FTRFRSRTGNNYAEKVLSAMRFGF
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 chain6vpb Chain B Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6vpb The structure of a novel membrane-associated 6-phosphogluconate dehydrogenase from Gluconacetobacter diazotrophicus (Gd6PGD) reveals a subfamily of short-chain 6PGDs.
Resolution1.87 Å
Binding residue
(original residue number in PDB)
D275 S276 G279 R280
Binding residue
(residue number reindexed from 1)
D275 S276 G279 R280
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004616 phosphogluconate dehydrogenase (decarboxylating) activity
GO:0046872 metal ion binding
GO:0050661 NADP binding
Biological Process
GO:0006098 pentose-phosphate shunt
GO:0016054 organic acid catabolic process
GO:0019521 D-gluconate metabolic process

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Molecular Function

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Biological Process
External links
PDB RCSB:6vpb, PDBe:6vpb, PDBj:6vpb
PDBsum6vpb
PubMed32621793
UniProtA9H324

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