Structure of PDB 3cbt Chain A Binding Site BS01

Receptor Information
>3cbt Chain A (length=210) Species: 100226 (Streptomyces coelicolor A3(2)) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GHWAPGSHILWRYRENGGPHVHIARPVTVVRDDADLLAVWLAPGTECVKP
VLADGTPVHLEPLATRYTKPRTVQRDQWFGTGVLKLARPGEAWSVWLFWD
PGWRFKNWYVNLERPLTRWEGGVDSEDHFLDISVHPDRTWHWRDEDEFAQ
ALRDGLMDPASAGRVRRAGRSAVAEIRAWGSPFADGWEHWRPDPAWPVPS
LPGDWDRTPA
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 chain3cbt Chain A Residue 301 [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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PDB3cbt Crystal structure of SC4828, a unique phosphatase from Streptomyces coelicolor.
Resolution1.7 Å
Binding residue
(original residue number in PDB)
N133 D149 D153
Binding residue
(residue number reindexed from 1)
N111 D127 D131
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.5: 5'-nucleotidase.
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:3cbt, PDBe:3cbt, PDBj:3cbt
PDBsum3cbt
PubMed
UniProtQ9FBN7

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