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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02507049

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ACHACETYLCHOLINEA,B2RIN0.74
ACHACETYLCHOLINEA,B2HA40.74
ACHACETYLCHOLINEA2ACE0.74
ACHACETYLCHOLINEA,B,C,D,E,F2J0H0.74
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A2AXN0.78
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A1NNF0.78
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A,B1ZLQ0.78
DO310-((2R)-2-HYDROXYPROPYL)-1,4,7,10-
TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID
A1H870.76
DO310-((2R)-2-HYDROXYPROPYL)-1,4,7,10-
TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID
A,B,C,D,E,F,
G,H
2QMI0.76
BCNBICINEA,B,C,D2V8H0.71
BCNBICINEA1QUS0.71
BCNBICINEA1LTM0.71
BCNBICINEA2JC50.71
BCNBICINEA,B,C,D1V0J0.71
BCNBICINEA1QDR0.71
BCNBICINEA1KI00.71
BCNBICINEY,Z1KMI0.71
BCNBICINEA,B,C2OV50.71
BCNBICINEA2A810.71
BCNBICINEA,B,C,D2V8G0.71
BCNBICINEA,B3HWR0.71
BCNBICINEA2R6S0.71
BCNBICINEA,B2R4J0.71
SCK2,2'-[(1,4-DIOXOBUTANE-1,4-DIYL)BIS(OXY)]BIS(N,N,N-
TRIMETHYLETHANAMINIUM)
A,B2HA20.7
SCK2,2'-[(1,4-DIOXOBUTANE-1,4-DIYL)BIS(OXY)]BIS(N,N,N-
TRIMETHYLETHANAMINIUM)
A,B2HA60.7