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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00021336

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BG1O-[(2S)-2-{methyl[(methylamino)sulfonyl]amino}pentanoyl]-
L-serine
A2RG30.71
C6LN-hexanoyl-L-homoserineA3DHA0.71
C6LN-hexanoyl-L-homoserineA3DHB0.71
ALOALLO-THREONINEI,P1HDT0.73
ALOALLO-THREONINEA2JUU0.73
ALOALLO-THREONINEA2VMX0.73
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.86
THCN-METHYLCARBONYLTHREONINEB2HR00.86
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.86
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.86
LBYN~6~-(TERT-BUTOXYCARBONYL)-L-LYSINEA2ZIN0.75
DSEN-METHYL-D-SERINEC1CWH0.74
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.78
SACN-ACETYL-SERINEA1R4U0.78
SACN-ACETYL-SERINEA,B,C,D1WS30.78
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.78
SACN-ACETYL-SERINEA,B1EVU0.78
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.78
SACN-ACETYL-SERINEA1WRR0.78
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.78
SACN-ACETYL-SERINEA,B3CVQ0.78
SACN-ACETYL-SERINEA1B0B0.78
SACN-ACETYL-SERINEA1XT40.78
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.78
SACN-ACETYL-SERINEA2FXL0.78
SACN-ACETYL-SERINEA1R4S0.78
SACN-ACETYL-SERINEA,B,C,D1WS20.78
SACN-ACETYL-SERINEA,B,C,D2AUC0.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.78
SACN-ACETYL-SERINEA1R510.78
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.78
SACN-ACETYL-SERINEA,B,C,D1XXJ0.78
SACN-ACETYL-SERINET2QAC0.78
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.78
LNTN-[(2S)-2-amino-1,1-dihydroxy-4-
methylpentyl]-L-threonine
A,B,C3B800.77
LNTN-[(2S)-2-amino-1,1-dihydroxy-4-
methylpentyl]-L-threonine
A,B,C3B7V0.77
OLTO-METHYL-L-THREONINEA,B,C2AOC0.71
OLTO-METHYL-L-THREONINEA,B,C2AOD0.71
DZEmethyl (3S)-3-[(tert-butoxycarbonyl)amino]-
4-oxopentanoate
A,B,C,D3GJR0.73
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.8
NXAN-CARBOXYALANINEA2IUX0.71
NXAN-CARBOXYALANINEA1O8A0.71
TH5O-acetyl-L-threonineA,D,E,F,G,H2VZK0.72
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
BAA(TERT-BUTYLOXYCARBONYL)-ALANYL-
ALANYL-AMINE
A1ELG0.7
CCLN~6~-[(CYCLOPENTYLOXY)CARBONYL]-
D-LYSINE
A2Q7G0.73
N10O-[(HEXYLAMINO)CARBONYL]-L-SERINEA,B,C,D,E,F,
G,H
2Q0S0.78
PAUPANTOTHENOIC ACIDA,B2F9W0.7
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BF10.7
PAUPANTOTHENOIC ACIDA,B,C,D1SQ50.7
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BEX0.7
DTHD-THREONINEA1KRO0.73
DTHD-THREONINEA,B,C,D3BOG0.73
DTHD-THREONINEA,B173D0.73
DTHD-THREONINEA209D0.73
DTHD-THREONINEA316D0.73
DTHD-THREONINEA,B2Q330.73
DTHD-THREONINEA2JUE0.73
DTHD-THREONINEA2D550.73