Structure of PDB 2qs8 Chain B Binding Site BS01

Receptor Information
>2qs8 Chain B (length=405) Species: 28108 (Alteromonas macleodii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DSKTLIHAGKLIDGKSDQVQSRISIVIDGNIISDIKKGFISSNDFEDYID
LRDHTVLPGLMDMHVHFGQEYQSKAQAPIKVEREMQAILATQHAYVTFKS
GFTTVRQVGDSGLVAISLRDAINSGKLAGPRIFAAGKTIATTGGHADPTN
GKAVDDYDYPVPEQGVVNGPYEVYAAVRQRYKDGADGIKITVTGGVLSVA
KSGQNPQFTQEEVDAVVSAAKDYGMWVAVHAHGAEGMKRAIKAGVDSIEH
GTFMDLEAMDLMIENGTYYVPTISAGEFVAEKSKIDNFFPEIVRPKAASV
GPQISDTFRKAYEKGVKIAFGTDAGVQKHGTNWKEFVYMVENGMPAMKAI
QSATMETAKLLRIEDKLGSIESGKLADLIAVKGNPIEDISVLENVDVVIK
DGLLY
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 chain2qs8 Chain B Residue 500 [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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PDB2qs8 Functional annotation of two new carboxypeptidases from the amidohydrolase superfamily of enzymes.
Resolution2.33 Å
Binding residue
(original residue number in PDB)
H69 H71 D328
Binding residue
(residue number reindexed from 1)
H64 H66 D323
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity
GO:0016810 hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:2qs8, PDBe:2qs8, PDBj:2qs8
PDBsum2qs8
PubMed19358546
UniProtK7N5L1

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