PDB ligand accession: TK0
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: XNJMWNJMIWAGCW-CRZWDPOYSA-N
SMILES: c1cc(cnc1)C=CC(=O)NCCc2ccc(cc2)c3cc4c(ncnc4s3)N5CCCC(C5)C(=O)NCc6ccc7c(c6)ccs7
Drug action: n/a
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8DSM | Download | Experimental | e8dsmB3 e8dsmA2 e8dsmB1 e8dsmA1 e8dsmA2 e8dsmC3 e8dsmD2 e8dsmC2 e8dsmD1 | alpha/beta-Hammerhead/Barrel-sandwich hybrid TIM beta/alpha-barrel TIM beta/alpha-barrel alpha/beta-Hammerhead/Barrel-sandwich hybrid TIM beta/alpha-barrel TIM beta/alpha-barrel alpha/beta-Hammerhead/Barrel-sandwich hybrid alpha/beta-Hammerhead/Barrel-sandwich hybrid TIM beta/alpha-barrel | LigPlot |