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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03207126

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AURAUROVERTIN BA,B,C,D,E,F1COW0.74
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one
A3B2S0.71
NEXA,B,C,D,E,F,
G,H,I,J
1RWT0.85
NEXA,B,C2BHW0.85
PIDPERIDININA2C9E0.8
PIDPERIDININM,N,O1PPR0.8
FUGFUMAGILLINA,B3FMQ0.79
FUGFUMAGILLINA1BOA0.79
KH15-(2-{1-[1-(4-ETHYL-4-HYDROXY-HEXYLOXY)-
ETHYL]-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE}-ETHYLIDENE)-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A1IE80.72
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A2RKV0.72
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A,B,C,D2ZBA0.72
XATA,B,C,D,E,F,
G,H,I,J
1RWT0.82
XATA,B,C2BHW0.82