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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03130993

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.91
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.91
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.88
GSHGLUTATHIONEA1EEM0.88
GSHGLUTATHIONEA,B1USB0.88
GSHGLUTATHIONEA3FZA0.88
GSHGLUTATHIONEA2IMF0.88
GSHGLUTATHIONEA,B1PX60.88
GSHGLUTATHIONEA,B1MD40.88
GSHGLUTATHIONEA2CZ20.88
GSHGLUTATHIONEA3FZ90.88
GSHGLUTATHIONEA,B,C,D1R4W0.88
GSHGLUTATHIONEA1ZHP0.88
GSHGLUTATHIONEA,B3E730.88
GSHGLUTATHIONEA1VF10.88
GSHGLUTATHIONEA3CRT0.88
GSHGLUTATHIONEA,B,C,D2VCX0.88
GSHGLUTATHIONEA,B,C,D1XW60.88
GSHGLUTATHIONEA3CRU0.88
GSHGLUTATHIONEA,B1B480.88
GSHGLUTATHIONEA2ZK20.88
GSHGLUTATHIONEA,B,C,D1IYH0.88
GSHGLUTATHIONEA,B,C,D1Q8M0.88
GSHGLUTATHIONEA,B,C,D2PBJ0.88
GSHGLUTATHIONEA,B,C,D2VCQ0.88
GSHGLUTATHIONEA1GRA0.88
GSHGLUTATHIONEA,B1QGJ0.88
GSHGLUTATHIONEA2HGS0.88
GSHGLUTATHIONEA,B,C,D2VD10.88
GSHGLUTATHIONEA1ZHM0.88
GSHGLUTATHIONEA,B,C,D2VCZ0.88
GSHGLUTATHIONEC1KCG0.88
GSHGLUTATHIONEA,B1MD30.88
GSHGLUTATHIONEA,B2IO90.88
GSHGLUTATHIONEA,B2JL40.88
GSHGLUTATHIONEA3DK80.88
GSHGLUTATHIONEA3DK40.88
GSHGLUTATHIONEA,B,D2VCW0.88
GSHGLUTATHIONEA,B1XW50.88
GSHGLUTATHIONEA,B3FHS0.88
GSHGLUTATHIONEA,B1Y1A0.88
GSHGLUTATHIONEA1GRE0.88
GSHGLUTATHIONEA,B2HT90.88
GSHGLUTATHIONEA,B1DUG0.88
GSHGLUTATHIONEA,B,C,D2VD00.88
GSHGLUTATHIONEA,B1TYP0.88
GSHGLUTATHIONEA2FLS0.88
GSHGLUTATHIONEA,B1OE80.88
GSHGLUTATHIONEA,B1PX70.88
GSHGLUTATHIONEA3C1S0.88
GSHGLUTATHIONEA,B1F3A0.88
GSHGLUTATHIONEA1FW10.88
GSHGLUTATHIONEA,B2IMI0.88
GSHGLUTATHIONEA,B1LBK0.88
GSHGLUTATHIONEA,B2HQM0.88
GSHGLUTATHIONEA,B1TDI0.88
GSHGLUTATHIONEA,B,C,D1V400.88
GSHGLUTATHIONEA,B,C,D1IYI0.88
GSHGLUTATHIONEA3D0Z0.88
GSHGLUTATHIONEA,B1ZGN0.88
GSHGLUTATHIONEA,B,C,D2CVD0.88
GSHGLUTATHIONEA,B3C8E0.88
GSHGLUTATHIONEA,B,C1YJ60.88
GSHGLUTATHIONEA2IMD0.88
GSHGLUTATHIONEA2IME0.88
GSHGLUTATHIONEA3BHJ0.88
GSHGLUTATHIONEA,B1OE70.88
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.84
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.84
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.84
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.84
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.84
GSFL-GAMMA-GLUTAMYL-3-SULFINO-L-ALANYLGLYCINEA,B1YZX0.83
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.81
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.79
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.79
DDD(5R,10S)-5-{[(CARBOXYMETHYL)AMINO]CARBONYL}-
7-OXO-3-THIA-1,6-DIAZABICYCLO[4.4.1]UNDECANE-
10-CARBOXYLIC ACID
A2PFG0.77
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.76
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.76
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.76
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.76
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.74
CYKN-hexanoyl-L-homocysteineA3DHC0.73
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.73
EPMN-PALMITOYL-L-METHIONINEA,B1ZO90.73
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.72
AMEN-ACETYLMETHIONINEA,B2J4Y0.72
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.72
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.72
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A1T3T0.7
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,B,C,D,E,F,
G,H
1A9X0.7
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,D,E,H,I,L3D540.7
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,B,C,D,E,F,
G,H
1CS00.7
ATAATRAZINE GLUTATHIONE CONJUGATEA,B,C,D1BYE0.7
GGAD-GAMMA-GLUTAMYL-N-{[(R)-{4-[(4-
AMINOBUTYL)AMINO]BUTYL}(PHOSPHONOOXY)PHOSPHORYL]METHYL}-
D-ALANINAMIDE
A,B2IOA0.7
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.7