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Attributes

UniProt ID
Protein Name
Threonine--tRNA ligase 1, cytoplasmic
Ligand Name
(1R,2R)-2-[(2S,4E,6E,8R,9S,11R,13S,15S,16S)-7-cyano-8,16-dihydroxy-9,11,13,15-tetramethyl-18-oxooxacyclooctadeca-4,6-dien-2-yl]cyclopentanecarboxylic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
OJCKRNPLOZHAOU-RSXXJMTFSA-N
SMILES
CC1CC(CC(C(C(=CC=CCC(OC(=O)CC(C(C1)C)O)C2CCCC2C(=O)O)C#N)O)C)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4P3N
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Color Legend
Unassigned regionsLigand / hetero atomse4p3nA1e4p3nA2e4p3nB1e4p3nB2e4p3nC1e4p3nC2e4p3nD1e4p3nD2
ECOD domains from experimental PDB structures interacting with ligand 2CR
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P26639n/a2CR4p3ne4p3nA1A:322-611
P26639n/a2CR4p3ne4p3nB1B:322-611
P26639n/a2CR4p3ne4p3nC1C:322-611
P26639n/a2CR4p3ne4p3nD1D:322-611