Structure of PDB 5hva Chain A Binding Site BS01

Receptor Information
>5hva Chain A (length=140) Species: 1299 (Deinococcus radiodurans) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PCPPTNAERLHEFHRAIGAATPERPTPPPPELLRLRQTLLDEESAEVRAE
IDHLLARQAAGEALSAGDLAPLAHELADLLYVTYGALDQLGIDADAVFAE
VHRANLSKASGPRRADGKQLKPEGWRPADVRGVIERLQHA
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 chain5hva Chain A Residue 201 [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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PDB5hva Deinococcus radiodurans DR2231 is a two-metal-ion mechanism hydrolase with exclusive activity on dUTP.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		E47 E50 E79 D82
Binding residue
(residue number reindexed from 1)		E43 E46 E75 D78
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
GO:0047429 nucleoside triphosphate diphosphatase activity

View graph for
Molecular Function
External links
PDB RCSB:5hva, PDBe:5hva, PDBj:5hva
PDBsum5hva
PubMed27739259
UniProtQ9RS96

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