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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03686217

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LEF(4S)-5-FLUORO-L-LEUCINEA1OGW0.71
FKI5,5-DI-FLUORO-2-KETO-3-AMINOPENTANOIC ACIDB,E,F1DY91
FKI5,5-DI-FLUORO-2-KETO-3-AMINOPENTANOIC ACIDA,B1DXW1
FKI5,5-DI-FLUORO-2-KETO-3-AMINOPENTANOIC ACIDE,F1DY81
OBF(2S)-2-amino-4,4-difluorobutanoic acidA,B2K1Q0.79
NVANORVALINEB,C1CA80.73
NVANORVALINEB,C,D1BA80.73
NVANORVALINEA1C9Y0.73
NVANORVALINEA,D2BTE0.73
NVANORVALINEA1OBH0.73
NVANORVALINEE,S1Z3P0.73
NVANORVALINEA1ZNM0.73
NVANORVALINEA1JDX0.73
NVANORVALINEA1FB50.73
NVANORVALINEA1OBC0.73
NVANORVALINE11YYY0.73
NVANORVALINEA,B1B6H0.73
NVANORVALINEA,B1ZZZ0.73
NVANORVALINEA,B,C2I6U0.73
NVANORVALINEB,C1BB00.73
NVANORVALINEE,S1Z3M0.73
B3A(3S)-3-AMINOBUTANOIC ACIDA,B,C2OXJ0.71
B3A(3S)-3-AMINOBUTANOIC ACIDA,B,C3HEZ0.71
B3A(3S)-3-AMINOBUTANOIC ACIDA2OXK0.71
AKL3-AMINO-5-CHLORO-4-OXOPENTANOIC ACIDI2DKO0.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEA2JCM0.73
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B1J970.73
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B2G070.73
BFDASPARTATE BERYLLIUM TRIFLUORIDEA1TA00.73
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B,C,D1RLO0.73
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B1ZDM0.73
BFDASPARTATE BERYLLIUM TRIFLUORIDEA3EF10.73
BFDASPARTATE BERYLLIUM TRIFLUORIDEE,F,G,H2FTK0.73
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B2HEG0.73
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J320.8
ASKDEHYDROXYMETHYLASPARTIC ACIDE,F1JXQ0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I2F4O0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I1X3Z0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJX0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J330.8
ASKDEHYDROXYMETHYLASPARTIC ACIDT,U,V,W,X,Y1QDU0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDC,D1CP30.8
ASKDEHYDROXYMETHYLASPARTIC ACIDA,B,C,D,E,F1M720.8
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J300.8
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J310.8
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJY0.8
B3D3-AMINOPENTANEDIOIC ACIDA,B,C2OXJ0.73
B3D3-AMINOPENTANEDIOIC ACIDA,B,C,D3C3F0.73
B3D3-AMINOPENTANEDIOIC ACIDA2OXK0.73
B3D3-AMINOPENTANEDIOIC ACIDA3C3G0.73
B3D3-AMINOPENTANEDIOIC ACIDA3C3H0.73
FLATRIFLUOROALANINEA1C0L0.71