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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02247857

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CS0S-(2-HYDROXYETHYL)-L-CYSTEINEA1ASV0.7
C3YS-[(1S)-1-HYDROXY-1-(HYDROXYAMINO)ETHYL]-
L-CYSTEINE
A2UXY0.73
CSAS-ACETONYLCYSTEINEA,B1DWQ0.73
CCSCARBOXYMETHYLATED CYSTEINEE1STF0.76
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D,E,F1GTI0.76
CCSCARBOXYMETHYLATED CYSTEINEA,B2BJ40.76
CCSCARBOXYMETHYLATED CYSTEINEA,B2JFA0.76
CCSCARBOXYMETHYLATED CYSTEINEG,R1DSS0.76
CCSCARBOXYMETHYLATED CYSTEINEA,B1L2I0.76
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D3DMT0.76
CCSCARBOXYMETHYLATED CYSTEINEA,B1ERR0.76
CCSCARBOXYMETHYLATED CYSTEINEA2JX40.76
ESC2-AMINO-4-ETHYL SULFANYL BUTYRIC ACIDH,P1KBG0.73
AGTS-{(S)-AMINO[(4-AMINOBUTYL)AMINO]METHYL}-
L-CYSTEINE
A3H7K0.74
AGTS-{(S)-AMINO[(4-AMINOBUTYL)AMINO]METHYL}-
L-CYSTEINE
A,B,C,D,E,F,
G,H
2JER0.74
BUCS,S-BUTYLTHIOCYSTEINEA1A2U0.7
MEDD-METHIONINEA1Y9Q0.71
MEDD-METHIONINEA,B2Q330.71
MEDD-METHIONINEA1ZUE0.71
MEDD-METHIONINEA1KQ00.71
MEDD-METHIONINEA,B3GP40.71
MEDD-METHIONINEA1TKJ0.71
BSC(S)-2-AMINO-4-(AMINO-BUTYLHYDROSULFINYL)BUTANOIC ACIDA,B,C,D,E,F,
G,H
2GWC0.73
MMEN-METHYL METHIONINEA,C,E,G,I,K,
M,O
1GK80.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.73
MMEN-METHYL METHIONINEA,E,S,W1WDD0.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.73
MMEN-METHYL METHIONINEA,B,C,D,S,T,
U,V
1IR10.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.73
MMEN-METHYL METHIONINE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z
1IR20.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.73
CBHS-(D-CARBOXYBUTYL)-L-HOMOCYSTEINEA,B1LT80.73
MT2[(3S)-3-amino-3-carboxypropyl](ethyl)methylsulfoniumA3C8F0.75
GT9S-NONYL-CYSTEINEA,B,C,D12GS0.74
2MT(4R)-2,2-DIMETHYL-1,3-THIAZOLIDINE-
4-CARBOXYLIC ACID
A1SBU0.75
AEA(2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-
ACETIC ACID
I1BZH0.71
AEA(2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-
ACETIC ACID
A,B,C,D1MHH0.71
CY1ACETAMIDOMETHYLCYSTEINEA,D1D5M0.76
CY4S-BUTYRYL-CYSTEINA,B,C,D1M4T0.75
ML32-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-
N,N,N-trimethylethanaminium
F3C1B0.87
MCSMALONYL CYSTEINEA,B,C,D2JFK0.72
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA2K3Y0.85
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA,E3C1C0.85