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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02469679

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AS52-(acetylamino)-4-O-[2-(acetylamino)-
2-deoxy-alpha-L-gulopyranosyl]-
1,5-anhydro-2-deoxy-D-mannitol		A,B2VLC0.73
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8G0.73
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8F0.73
FSMFORSMANN ANTIGENA2CGY0.73
AKN(2R)-4-AMINO-N-{(1R,2S,3S,4R,5S)-
5-AMINO-2-[(3-AMINO-3-DEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-4-[(6-AMINO-
6-DEOXY-ALPHA-D-GLUCOPYRANOSYL)OXY]-
3-HYDROXYCYCLOHEXYL}-2-HYDROXYBUTANAMIDE		A,B2G5Q0.7
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA,C,E,G1UH10.72
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA,B,C,D2DU10.72
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA,C,E,G1UH00.72
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA,B,C,D2DVA0.72
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA1UGX0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1M7D0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1LED0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1GSL0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1FWU0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA,B,C,D1G1R0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1FWV0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1G1T0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINE1,2,33KMB0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINE1,2,32KMB0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA,B1ZPL0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINE1,2,34KMB0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA,H1UZ80.72
NXDMETHYL 5-(ACETYLAMINO)-9-{[AMINO(OXO)ACETYL]AMINO}-
3,5,9-TRIDEOXY-D-GLYCERO-ALPHA-
D-GLUCO-NON-2-ULOPYRANOSIDONIC ACID		A2G5R0.71
YX12-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-
beta-D-glucopyranose		A,B2VUR0.73
CTOTRIACETYLCHITOTRIOSEA,B1BB50.7
CTOTRIACETYLCHITOTRIOSEB2H5Z0.7
CTOTRIACETYLCHITOTRIOSEA,B,C,D2R0H0.7
CTOTRIACETYLCHITOTRIOSEA,B,C2AH90.7
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE		A3E6J0.7
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE		A1ZJ30.7
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE		A1ZI40.7
EAG2-aminoethyl 2-(acetylamino)-2-
deoxy-beta-D-glucopyranoside		B,D,E,F,H3BZ40.72
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1LJN0.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1ZU00.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)A2HRH0.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,B1TW50.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,H2HRG0.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)12BS70.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1C7T0.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,B2QT60.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1QBB0.73
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1C7S0.73
MU2N-ACETYLMURAMYL-L-ALANYL-D-ISOGLUTAMINEA2IXV0.75
MU2N-ACETYLMURAMYL-L-ALANYL-D-ISOGLUTAMINEA2IXU0.75
GTH3-O-GLUCOPYRANOSYL-THREONINE-[2-
DEOXY-2-ACETAMIDO-GLUCOPYRANOSIDE]		A1WCT0.79
STZSTREPTOZOTOCINA2W4X0.75
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE		A,B,C,D1N470.79
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE		A2CGZ0.79
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE		A,B,C,D2D3S0.79
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE		A2D7R0.79
AB9(2R)-4-AMINO-N-{(1R,2S,3R,4R,5S)-
5-AMINO-2-{2-[(2-AMINOETHYL)AMINO]ETHOXY}-
4-[(2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-3-HYDROXYCYCLOHEXYL}-
2-HYDROXYBUTANAMIDE		A,D,M,N,Z2F4V0.73
AB9(2R)-4-AMINO-N-{(1R,2S,3R,4R,5S)-
5-AMINO-2-{2-[(2-AMINOETHYL)AMINO]ETHOXY}-
4-[(2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-3-HYDROXYCYCLOHEXYL}-
2-HYDROXYBUTANAMIDE		B2F4T0.73
GYTBIS-(2-ACETAMIDO-2-DEOXY-ALPHA-
D-GLUCOPYRANOSYLOXYCARBONYL)-4,7,10-
TRIOXA-1,13-TRIDECANEDIAMINE		A,B2UWZ0.72
BGNN-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDEA,B,C,D1NWG0.72
AB6(2R)-4-AMINO-N-((1R,2S,3R,4R,5S)-
5-AMINO-4-[(2-AMINO-2-DEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-2-{2-[(3-
AMINOPROPYL)AMINO]ETHOXY}-3-HYDROXYCYCLOHEXYL)-
2-HYDROXYBUTANAMIDE		B2F4U0.72
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A,B2VS40.71
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A1W3G0.71
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A,B3EHN0.71
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A1W3F0.71
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A1ZJ10.71
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A2YY10.71
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A1ZI30.71
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A,B2VS30.71
B31(2S)-4-amino-N-[(1R,2S,3R,4R,5S)-
5-amino-4-[(2,6-diamino-2,6-dideoxy-
alpha-D-glucopyranosyl)oxy]-2-hydroxy-
3-(beta-D-xylofuranosyloxy)cyclohexyl]-
2-hydroxybutanamide		A3H8P0.7
AMUBETA-N-ACETYLMURAMIC ACIDA,B,C,D2APH0.71
AMUBETA-N-ACETYLMURAMIC ACIDA,P1TWQ0.71
AMUBETA-N-ACETYLMURAMIC ACIDA1D0K0.71
AMUBETA-N-ACETYLMURAMIC ACIDS9LYZ0.71
AMUBETA-N-ACETYLMURAMIC ACIDE,S148L0.71
AMUBETA-N-ACETYLMURAMIC ACIDD,K3CYQ0.71
AMUBETA-N-ACETYLMURAMIC ACIDU2AIZ0.71
GYUGLYCOSYLURETHANA,B2UWG0.72
MUBN-ACETYLMURAMIC ACIDL,N1WCO0.71
MA8(2S,3R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXYL 2-
(L-CYSTEINYLAMINO)-2-DEOXY-ALPHA-
L-GLUCOPYRANOSIDE		A2C270.71