DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Protease
Ligand Name
(betaS)-4-chloro-beta-(3,5-difluorophenyl)-N-(5-fluoro-4-{2-[(2R,5S)-5-({[(2,2,2-trifluoroethyl)carbamoyl]oxy}methyl)morpholin-2-yl]ethyl}pyridin-3-yl)-L-phenylalaninamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
OUUHZXOSBUCFJO-ZKBLBJRCSA-N
SMILES
c1cc(ccc1C(c2cc(cc(c2)F)F)C(C(=O)Nc3cncc(c3CCC4CNC(CO4)COC(=O)NCC(F)(F)F)F)N)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5IVT
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Color Legend
Unassigned regionsLigand / hetero atomse5ivtA1e5ivtB1
ECOD domains from experimental PDB structures interacting with ligand 6EE
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
C8B467n/a6EE5ivte5ivtA1A:1-99
C8B467n/a6EE5ivte5ivtB1B:1-99