DrugDomain logoDrugDomain

Attributes

UniProt ID
Q27709
Protein Name
Obelin
Ligand Name
N-[3-BENZYL-5-(4-HYDROXYPHENYL)PYRAZIN-2-YL]-2-(4-HYDROXYPHENYL)ACETAMIDE
DrugBank ID
DB04049
PDB Ligand Accession
CEI
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CJIIERPDFZUYPI-UHFFFAOYSA-N
SMILES
c1ccc(cc1)Cc2c(ncc(n2)c3ccc(cc3)O)NC(=O)Cc4ccc(cc4)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Mol*
Structure: 1S36
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Color Legend
Unassigned regionsLigand / hetero atomse1s36A1e1s36A2
ECOD domains from experimental PDB structures interacting with ligand DB04049
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q27709DB04049CEI1s36e1s36A1A:108-195
Q27709DB04049CEI1s36e1s36A2A:7-107
Q27709DB04049CEI2f8pe2f8pA1A:108-191
Q27709DB04049CEI2f8pe2f8pA2A:2-107
Q27709DB04049CEI4mrye4mryA1A:9-107
Q27709DB04049CEI4mrye4mryA2A:108-195
Q27709DB04049CEI4n1ge4n1gA1A:108-195
Q27709DB04049CEI4n1ge4n1gA2A:2-107
Q27709DB04049CEI4n1ge4n1gB1B:108-195
Q27709DB04049CEI4n1ge4n1gB2B:2-107