DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Threonine--tRNA ligase
Ligand Name
(2S,3R)-2-azanyl-N-[(1R)-2-[3-[6,7-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]propanoylamino]-1-[3-[4-(trifluoromethyl)phenyl]phenyl]ethyl]-3-oxidanyl-butanamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MITSAJKYFZWXSM-YDZMPMGISA-N
SMILES
CC(C(C(=O)NC(CNC(=O)CCN1C=Nc2cc(c(cc2C1=O)Cl)Cl)c3cccc(c3)c4ccc(cc4)C(F)(F)F)N)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 7WMF
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Color Legend
Unassigned regionsLigand / hetero atomse7wmfA1e7wmfA2e7wmfB1e7wmfB2
ECOD domains from experimental PDB structures interacting with ligand 9I9
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
V7II86n/a9I97wmfe7wmfA1A:241-532
V7II86n/a9I97wmfe7wmfB1B:241-532