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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03495270

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MPTBETA-MERCAPTOPROPIONIC ACIDG,M,P,S1YYL0.8
MPTBETA-MERCAPTOPROPIONIC ACIDG,M,P,S2I600.8
MPTBETA-MERCAPTOPROPIONIC ACIDA,B1XY10.8
MPTBETA-MERCAPTOPROPIONIC ACIDA,B1K090.8
MPTBETA-MERCAPTOPROPIONIC ACIDG,M,P,S1YYM0.8
MPTBETA-MERCAPTOPROPIONIC ACIDG,M,P,S2I5Y0.8
MPTBETA-MERCAPTOPROPIONIC ACIDA,B,C2VDN0.8
BUABUTANOIC ACIDA2CZ00.71
BUABUTANOIC ACIDA1P0I0.71
BUABUTANOIC ACIDA,B2HA70.71
BUABUTANOIC ACIDA1UK70.71
BUABUTANOIC ACIDA2J4C0.71
BUABUTANOIC ACIDA1ZRM0.71
BUABUTANOIC ACIDA3DLT0.71
BUABUTANOIC ACIDA1UGP0.71
BUABUTANOIC ACIDA,B2CZ10.71
KMT4-(METHYLSULFANYL)-2-OXOBUTANOIC ACIDA,B1V2E0.81
313(dimethyl-lambda~4~-sulfanyl)acetic acidA,B,C,D3CHG0.9
ALQ2-METHYL-PROPIONIC ACIDC,D1FKN0.71
ALQ2-METHYL-PROPIONIC ACIDC,D2ZHR0.71
ALQ2-METHYL-PROPIONIC ACIDA1IUP0.71
ALQ2-METHYL-PROPIONIC ACIDC,D1M4H0.71
ALQ2-METHYL-PROPIONIC ACIDA1R6N0.71
ALQ2-METHYL-PROPIONIC ACIDE,F,G,H1XN20.71
MYQ(S)-(1,2-DICARBOXYETHYLTHIO)GOLDA2ATO0.71
PIVPIVALIC ACIDB,D,F,H1SMR0.71
ASF3-(BUTYLSULPHONYL)-PROPANOIC ACIDA,B2VEK0.81
MCRSULFANYLACETIC ACIDA,B1T0S0.7
MCRSULFANYLACETIC ACIDA,B1T0Q0.7
MCRSULFANYLACETIC ACIDC,D,G,H1NU70.7
MCRSULFANYLACETIC ACIDB,C,E,F1NU90.7
MTG[METHYLTHIO]ACETATEA,B1EL90.76