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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02485830

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MRCMUPIROCINA1JZS0.76
MRCMUPIROCINA,T1FFY0.76
MRCMUPIROCINA1QU30.76
MRCMUPIROCINA,T1QU20.76
XATA,B,C,D,E,F,
G,H,I,J
1RWT0.73
XATA,B,C2BHW0.73
NEXA,B,C,D,E,F,
G,H,I,J
1RWT0.75
NEXA,B,C2BHW0.75
DGXDIGOXINB,D1IGJ0.75
DOGDIGOXIGENINA1LKE0.76
FSCFUSICOCCINA1O9E0.78
FSCFUSICOCCINA,P1O9F0.78
FSCFUSICOCCINA,B2O980.78
SWISWINHOLIDE AA,B1YXQ0.73
FUGFUMAGILLINA,B3FMQ0.81
FUGFUMAGILLINA1BOA0.81
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A2RKV0.9
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A,B,C,D2ZBA0.9
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one
A3B2S0.8
OBNOUABAINH,L1IBG0.77
CW1Cotylenin AA,B,C,D3E6Y0.7
AURAUROVERTIN BA,B,C,D,E,F1COW0.83
TG1A,B2AGV0.71
TG1A2ZBF0.71
TG1A2ZBG0.71
TG1A,B,C,D1WPG0.71
TG1A2C8L0.71
TG1A2EAR0.71
TG1A,B1IWO0.71
TG1A2C880.71
TG1A2DQS0.71
TG1A2C8K0.71
TG1A1XP50.71
TG1A2EAT0.71
SXNSalinixanthinA,B3DDL0.74
SRNSORANGICIN AC,D1YNJ0.77
DTXDIGITOXIGENINA1LNM0.75
PIDPERIDININA2C9E0.84
PIDPERIDININM,N,O1PPR0.84