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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813657

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B1ECM0.73
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B,C,D,E,F,
G,H,I,J,K,L
2CHT0.73
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
X2GTV0.73
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
H1FIG0.73
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B4CSM0.73
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B3CSM0.73
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
B2FP20.73
FA12,3 -ANHYDRO-QUINIC ACIDA1H0R0.78
FA12,3 -ANHYDRO-QUINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1GU10.78
FA12,3 -ANHYDRO-QUINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
2C570.78
DHK3-DEHYDROSHIKIMATEA1WE20.72
DHK3-DEHYDROSHIKIMATEA,B1SFJ0.72
DHK3-DEHYDROSHIKIMATEA,B,C,D,E,F,
G,H,I,J,K,L
1GTZ0.72
DHK3-DEHYDROSHIKIMATEA2O7Q0.72
DHK3-DEHYDROSHIKIMATEA2O7S0.72
PREPREPHENIC ACIDA,B,C,D,E,F,
G,H,K
1COM1
FA32-ANHYDRO-3-FLUORO-QUINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1V1J0.75
TSO(1R,3S,5S,8R)-8-HYDROXY-2-OXABICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B,C,D2W1A0.73