Structure of PDB 5hwu Chain B Binding Site BS03

Receptor Information
>5hwu Chain B (length=131) Species: 243230 (Deinococcus radiodurans R1 = ATCC 13939 = DSM 20539) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PPTNAERLHEFHRAIGAATPERPTPPPPELLRLRQTLLDAESAEVRAEID
HLLARQAAGEALSAGDLAPLAHELADLLYVTYGALDQLGIDADAVFAEVH
RANLSKASGPLKPEGWRPADVRGVIERLQHA
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain5hwu Chain B Residue 203 [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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PDB5hwu 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)		H78 D82
Binding residue
(residue number reindexed from 1)		H72 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:5hwu, PDBe:5hwu, PDBj:5hwu
PDBsum5hwu
PubMed27739259
UniProtQ9RS96

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