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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03943630

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
C6LN-hexanoyl-L-homoserineA3DHA0.71
C6LN-hexanoyl-L-homoserineA3DHB0.71
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.78
THCN-METHYLCARBONYLTHREONINEB2HR00.78
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.78
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.78
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.71
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.7
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.7
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.7
SACN-ACETYL-SERINEA1R4U0.7
SACN-ACETYL-SERINEA,B,C,D1WS30.7
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.7
SACN-ACETYL-SERINEA,B1EVU0.7
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.7
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.7
SACN-ACETYL-SERINEA1WRR0.7
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.7
SACN-ACETYL-SERINEA,B3CVQ0.7
SACN-ACETYL-SERINEA1B0B0.7
SACN-ACETYL-SERINEA1XT40.7
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.7
SACN-ACETYL-SERINEA2FXL0.7
SACN-ACETYL-SERINEA1R4S0.7
SACN-ACETYL-SERINEA,B,C,D1WS20.7
SACN-ACETYL-SERINEA,B,C,D2AUC0.7
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.7
SACN-ACETYL-SERINEA1R510.7
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.7
SACN-ACETYL-SERINEA,B,C,D1XXJ0.7
SACN-ACETYL-SERINET2QAC0.7
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.7
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.7
LNTN-[(2S)-2-amino-1,1-dihydroxy-4-
methylpentyl]-L-threonine
A,B,C3B800.72
LNTN-[(2S)-2-amino-1,1-dihydroxy-4-
methylpentyl]-L-threonine
A,B,C3B7V0.72
097(2S,3R)-N~4~-[(1S)-2,2-dimethyl-
1-(methylcarbamoyl)propyl]-N~1~,2-
dihydroxy-3-(2-methylpropyl)butanediamide
A,B3HY70.7
097(2S,3R)-N~4~-[(1S)-2,2-dimethyl-
1-(methylcarbamoyl)propyl]-N~1~,2-
dihydroxy-3-(2-methylpropyl)butanediamide
A,B2JIH0.7
097(2S,3R)-N~4~-[(1S)-2,2-dimethyl-
1-(methylcarbamoyl)propyl]-N~1~,2-
dihydroxy-3-(2-methylpropyl)butanediamide
A1R550.7
PAUPANTOTHENOIC ACIDA,B2F9W0.75
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BF10.75
PAUPANTOTHENOIC ACIDA,B,C,D1SQ50.75
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BEX0.75
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.73
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.73
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.73