DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Hemoglobin subunit beta
Ligand Name
(2R)-2-({(2S)-3-(biphenyl-4-yl)-2-[(3,5-dimethylbenzoyl)(methyl)amino]propanoyl}amino)-3-(1H-indol-3-yl)propanoic acid (non-preferred name)
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
UZDORQWMYRRLQV-SAIUNTKASA-N
SMILES
Cc1cc(cc(c1)C(=O)N(C)C(Cc2ccc(cc2)c3ccccc3)C(=O)NC(Cc4c[nH]c5c4cccc5)C(=O)O)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 4L7Y
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Color Legend
Unassigned regionsLigand / hetero atomse4l7yA1e4l7yB1e4l7yC1e4l7yD1
ECOD domains from experimental PDB structures interacting with ligand IRL
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P68871n/aIRL4l7ye4l7yB1B:2-146
P68871n/aIRL4l7ye4l7yD1D:2-146