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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206646

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CBHS-(D-CARBOXYBUTYL)-L-HOMOCYSTEINEA,B1LT80.8
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB20.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOU0.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOS0.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNS0.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOV0.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB30.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB10.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNG0.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNO0.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNV0.72
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOQ0.72
C3YS-[(1S)-1-HYDROXY-1-(HYDROXYAMINO)ETHYL]-
L-CYSTEINE
A2UXY0.73
CS0S-(2-HYDROXYETHYL)-L-CYSTEINEA1ASV0.77
CSAS-ACETONYLCYSTEINEA,B1DWQ0.77
2FMS-(DIFLUOROMETHYL)HOMOCYSTEINEA1PFV0.77
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A1T3T0.74
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,B,C,D,E,F,
G,H
1A9X0.74
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,D,E,H,I,L3D540.74
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,B,C,D,E,F,
G,H
1CS00.74
BSC(S)-2-AMINO-4-(AMINO-BUTYLHYDROSULFINYL)BUTANOIC ACIDA,B,C,D,E,F,
G,H
2GWC0.74
CY4S-BUTYRYL-CYSTEINA,B,C,D1M4T0.82
CMTO-METHYLCYSTEINEG1OMW0.71
CMTO-METHYLCYSTEINEA,G3CIK0.71
CMTO-METHYLCYSTEINEA1DOA0.71
CXMN-CARBOXYMETHIONINEA,B1DNA0.7
CXMN-CARBOXYMETHIONINEA,B1JTU0.7
CXMN-CARBOXYMETHIONINEA,B1F4F0.7
CXMN-CARBOXYMETHIONINEA,B3BHL0.7
CXMN-CARBOXYMETHIONINEA,B2G8M0.7
CXMN-CARBOXYMETHIONINEA,C1S3T0.7
CXMN-CARBOXYMETHIONINEA2FTN0.7
CXMN-CARBOXYMETHIONINEA1AJM0.7
CXMN-CARBOXYMETHIONINEA1EV80.7
CXMN-CARBOXYMETHIONINEA,B2G8O0.7
CXMN-CARBOXYMETHIONINEA1EV50.7
CXMN-CARBOXYMETHIONINEA,B1JG00.7
CXMN-CARBOXYMETHIONINEA1FFL0.7
CXMN-CARBOXYMETHIONINEA1BJG0.7
CXMN-CARBOXYMETHIONINEA,B1TLS0.7
CXMN-CARBOXYMETHIONINEA,B1KCE0.7
CXMN-CARBOXYMETHIONINEA,B1NCE0.7
CXMN-CARBOXYMETHIONINEA1TSN0.7
CXMN-CARBOXYMETHIONINEA1F4B0.7
CXMN-CARBOXYMETHIONINEA,B1F4G0.7
CXMN-CARBOXYMETHIONINEA,B,C,D,E,F1KZJ0.7
CXMN-CARBOXYMETHIONINEA3B9H0.7
CXMN-CARBOXYMETHIONINEA,B,C,D,E,F1NKZ0.7
CXMN-CARBOXYMETHIONINEA3BHR0.7
CXMN-CARBOXYMETHIONINEA,B1KZI0.7
CXMN-CARBOXYMETHIONINEA1EVG0.7
CXMN-CARBOXYMETHIONINEA,B1F4C0.7
CXMN-CARBOXYMETHIONINEA,B1FWM0.7
CXMN-CARBOXYMETHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,R,S
2FKW0.7
CXMN-CARBOXYMETHIONINEA1EVF0.7
CXMN-CARBOXYMETHIONINEA,B1F4D0.7
CXMN-CARBOXYMETHIONINEA,B1JUT0.7
CXMN-CARBOXYMETHIONINEA,B,C,D2A9W0.7
CXMN-CARBOXYMETHIONINEX2FTO0.7
CXMN-CARBOXYMETHIONINEA,B1AIQ0.7
CXMN-CARBOXYMETHIONINEA1QQQ0.7
CXMN-CARBOXYMETHIONINEA,B1JTQ0.7
CXMN-CARBOXYMETHIONINEA,B1BQ10.7
CXMN-CARBOXYMETHIONINEA,C1UBP0.7
CXMN-CARBOXYMETHIONINEA3BFI0.7
CXMN-CARBOXYMETHIONINEA,B2G8X0.7
CXMN-CARBOXYMETHIONINEA,B2VF00.7
CXMN-CARBOXYMETHIONINEA,B1ZPR0.7
CXMN-CARBOXYMETHIONINEA3BGX0.7
CXMN-CARBOXYMETHIONINEA1TYS0.7
CXMN-CARBOXYMETHIONINEA2FTQ0.7
CXMN-CARBOXYMETHIONINEA1F4E0.7
CXMN-CARBOXYMETHIONINEA,C1IE70.7
CYQ2-AMINO-3-PHOSPHONOMETHYLSULFANYL-
PROPIONIC ACID
A1C4W0.73
CYQ2-AMINO-3-PHOSPHONOMETHYLSULFANYL-
PROPIONIC ACID
A2ID70.73
CYQ2-AMINO-3-PHOSPHONOMETHYLSULFANYL-
PROPIONIC ACID
A2ID90.73
CYQ2-AMINO-3-PHOSPHONOMETHYLSULFANYL-
PROPIONIC ACID
A2IDM0.73
AEA(2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-
ACETIC ACID
I1BZH0.75
AEA(2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-
ACETIC ACID
A,B,C,D1MHH0.75
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3G2F0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1FU10.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM20.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2CJW0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2JBH0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1JQ60.72
CASS-(DIMETHYLARSENIC)CYSTEINEB2HZE0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM30.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2H790.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2ILZ0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM10.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1RA60.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1TQL0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2RA80.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1I830.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3E7S0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1ZZS0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2ILY0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM00.72
CASS-(DIMETHYLARSENIC)CYSTEINEX3GWS0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2W9J0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1ZZT0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA2H770.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1FYX0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2HMH0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1BHL0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B,C1FF30.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1R4X0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1S6C0.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1RA70.72
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3ET60.72
CASS-(DIMETHYLARSENIC)CYSTEINEA1FYW0.72
CSRS-ARSONOCYSTEINEA1SK10.73
CSRS-ARSONOCYSTEINEA1JZW0.73
CSRS-ARSONOCYSTEINEA1OKG0.73
CSRS-ARSONOCYSTEINEA1LJU0.73
BUCS,S-BUTYLTHIOCYSTEINEA1A2U0.71
CCSCARBOXYMETHYLATED CYSTEINEE1STF0.84
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D,E,F1GTI0.84
CCSCARBOXYMETHYLATED CYSTEINEA,B2BJ40.84
CCSCARBOXYMETHYLATED CYSTEINEA,B2JFA0.84
CCSCARBOXYMETHYLATED CYSTEINEG,R1DSS0.84
CCSCARBOXYMETHYLATED CYSTEINEA,B1L2I0.84
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D3DMT0.84
CCSCARBOXYMETHYLATED CYSTEINEA,B1ERR0.84
CCSCARBOXYMETHYLATED CYSTEINEA2JX40.84
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RHY0.94
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RHU0.94
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RI20.94
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RI30.94
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RI50.94
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RHZ0.94
ASIL-ISO-ASPARTATEA1EJC0.71
ASIL-ISO-ASPARTATEA,B1EJD0.71
ASIL-ISO-ASPARTATEA,B,C,D1YBG0.71
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H
1RYW0.71
ASIL-ISO-ASPARTATEA,B,C,D2Z2C0.71
ASIL-ISO-ASPARTATEA,B,C,D1JG30.71
ASIL-ISO-ASPARTATEA,B1DLG0.71
ASIL-ISO-ASPARTATEA,B,C,D2HSE0.71
ASIL-ISO-ASPARTATEA1EYN0.71
ASIL-ISO-ASPARTATEA2JV00.71
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H,I,J,K,L,
W,X,Y,Z
1Q3G0.71
CAFS-DIMETHYLARSINOYL-CYSTEINEA,B2DYB0.72
CAFS-DIMETHYLARSINOYL-CYSTEINEA1HYV0.72
CAFS-DIMETHYLARSINOYL-CYSTEINEA,B,C,D2C7V0.72
CAFS-DIMETHYLARSINOYL-CYSTEINEA1SNG0.72
CAFS-DIMETHYLARSINOYL-CYSTEINEA2IWR0.72
CAFS-DIMETHYLARSINOYL-CYSTEINEA2FAU0.72
CAFS-DIMETHYLARSINOYL-CYSTEINEA1HYZ0.72
CAFS-DIMETHYLARSINOYL-CYSTEINEA3F7D0.72