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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02391066

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
XATA,B,C,D,E,F,
G,H,I,J
1RWT0.75
XATA,B,C2BHW0.75
PIDPERIDININA2C9E0.81
PIDPERIDININM,N,O1PPR0.81
RGCREIDISPONGIOLIDE CA2ASP0.75
DOGDIGOXIGENINA1LKE0.71
AURAUROVERTIN BA,B,C,D,E,F1COW0.77
SWISWINHOLIDE AA,B1YXQ0.75
SXNSalinixanthinA,B3DDL0.71
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A,B,E1R8Q0.75
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A1RE00.75
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A,E1S9D0.75
MRCMUPIROCINA1JZS0.78
MRCMUPIROCINA,T1FFY0.78
MRCMUPIROCINA1QU30.78
MRCMUPIROCINA,T1QU20.78
DTXDIGITOXIGENINA1LNM0.7
FSCFUSICOCCINA1O9E0.71
FSCFUSICOCCINA,P1O9F0.71
FSCFUSICOCCINA,B2O980.71
FUGFUMAGILLINA,B3FMQ0.97
FUGFUMAGILLINA1BOA0.97
MEI(2E,4E)-11-METHOXY-3,7,11-TRIMETHYLDODECA-
2,4-DIENOIC ACID
A,B1UHL0.73
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A2RKV0.73
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A,B,C,D2ZBA0.73
NEXA,B,C,D,E,F,
G,H,I,J
1RWT0.76
NEXA,B,C2BHW0.76
SRNSORANGICIN AC,D1YNJ0.74