Structure of PDB 5hx1 Chain C Binding Site BS02

Receptor Information
>5hx1 Chain C (length=130) Species: 1299 (Deinococcus radiodurans) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PPTNAERLHEFHRAIGAATPERPTPPPPELLRLRQTLLDAESAEVRAEID
HLLARQAAGEALSAGDLAPLAHELADLLYVTYGALDQLGIDADAVFAEVH
RANLSKASGLKPEGWRPADVRGVIERLQHA
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 chain5hx1 Chain C Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5hx1 Deinococcus radiodurans DR2231 is a two-metal-ion mechanism hydrolase with exclusive activity on dUTP.
Resolution1.799 Å
Binding residue
(original residue number in PDB)		E47 E50 E79 D82
Binding residue
(residue number reindexed from 1)		E41 E44 E73 D76
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:5hx1, PDBe:5hx1, PDBj:5hx1
PDBsum5hx1
PubMed27739259
UniProtQ9RS96

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