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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03506618

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MCO1-(3-MERCAPTO-2-METHYL-PROPIONYL)-
PYRROLIDINE-2-CARBOXYLIC ACID
A,B,C,D1M2X0.88
MCO1-(3-MERCAPTO-2-METHYL-PROPIONYL)-
PYRROLIDINE-2-CARBOXYLIC ACID
A,B1J370.88
MCO1-(3-MERCAPTO-2-METHYL-PROPIONYL)-
PYRROLIDINE-2-CARBOXYLIC ACID
A1UZF0.88
MCO1-(3-MERCAPTO-2-METHYL-PROPIONYL)-
PYRROLIDINE-2-CARBOXYLIC ACID
A,B2FU80.88
MCO1-(3-MERCAPTO-2-METHYL-PROPIONYL)-
PYRROLIDINE-2-CARBOXYLIC ACID
A2QDS0.88
MCO1-(3-MERCAPTO-2-METHYL-PROPIONYL)-
PYRROLIDINE-2-CARBOXYLIC ACID
A1JT10.88
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.71
GTXS-HEXYLGLUTATHIONEA,B1AGS0.71
GTXS-HEXYLGLUTATHIONEA,B1PN90.71
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.71
GTXS-HEXYLGLUTATHIONEA,B2IMK0.71
GTXS-HEXYLGLUTATHIONEA,B4GSS0.71
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.71
GTXS-HEXYLGLUTATHIONEA,B2GLR0.71
GTXS-HEXYLGLUTATHIONEA,B2OA70.71
GTXS-HEXYLGLUTATHIONEA,C2AAW0.71
GTXS-HEXYLGLUTATHIONEA,B1VF20.71
GTXS-HEXYLGLUTATHIONEA1M9A0.71
GTXS-HEXYLGLUTATHIONEA,B17GS0.71
GTXS-HEXYLGLUTATHIONEA,B1K0A0.71
GTXS-HEXYLGLUTATHIONEA,B2R3X0.71
GTXS-HEXYLGLUTATHIONEA,B1GSU0.71
GTXS-HEXYLGLUTATHIONEA,B2C800.71
GTXS-HEXYLGLUTATHIONEA,B2R6K0.71
GTXS-HEXYLGLUTATHIONEA,B1PGT0.71
GTXS-HEXYLGLUTATHIONEA,B2J9H0.71
GTXS-HEXYLGLUTATHIONEA,B1K3L0.71
GTXS-HEXYLGLUTATHIONEA,B1GNW0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.71
GTXS-HEXYLGLUTATHIONEA,B1YDK0.71
GTXS-HEXYLGLUTATHIONEA,B9GSS0.71
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.73
PBE1,1-DIMETHYL-PROLINIUMA,B2B4M0.72
PBE1,1-DIMETHYL-PROLINIUMA1R9Q0.72
PBE1,1-DIMETHYL-PROLINIUMA,B1SW10.72
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.7
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.7
N7P1-ACETYL-D-PROLINEA,B,C1NX80.78