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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03854333

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2OS3-N-OCTANOYLSUCROSEA,B1T3I0.71
289D-glycero-alpha-D-manno-heptopyranoseA,B,C2RIA0.72
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.73
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B,C,D1VAQ0.74
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKH0.74
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKI0.74
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1D830.74
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEI,J,K,L,M,N,
O,P
1JZ10.72
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEA,B,C,D,E,F,
G,H
1JZ00.72
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEA,B,C,D1JZ20.72
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKH0.79
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKI0.79
3MG3-O-methyl-beta-D-glucopyranoseA2QW10.74
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.71
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.71
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.71
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.71
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.71
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.71
2DG2-DEOXY-BETA-D-GALACTOSEA,B,C,D1JZ30.75
2DG2-DEOXY-BETA-D-GALACTOSEA,B,C,D1JZ40.75
AAL3,6-ANHYDRO-L-GALACTOSEA,B,C,D2CDO0.7
AAL3,6-ANHYDRO-L-GALACTOSEA,B1AGA0.7
AAL3,6-ANHYDRO-L-GALACTOSEA,B,C,D2CDP0.7
AAL3,6-ANHYDRO-L-GALACTOSEA1URX0.7
293(2S,4R,5S,6R)-6-((S)-1,2-dihydroxyethyl)tetrahydro-
2H-pyran-2,4,5-triol
A,B,C2RIE0.72
2GS2-O-METHYL-ALPHA-D-GALACTOPYRANOSEA,B,C,D2DTW0.72
46M(4AR,6R,7S,8R,8AS)-HEXAHYDRO-6,7,8-
TRIHYDROXY-2-METHYLPYRANO[3,2-D][1,3]DIOXINE-
2-CARBOXYLIC ACID
A1X1I0.77
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.88
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.88
46D(4AR,6R,7S,8R,8AR)-8-((5R,6R)-3-
CARBOXY-TETRAHYDRO-4,5,6-TRIHYDROXY-
2H-PYRAN-2-YLOXY)-HEXAHYDRO-6,7-
DIHYDROXY-2-METHYLPYRANO[3,2-D][1,3]DIOXINE-
2-CARBOXYLIC ACID)
A1X1J0.8
ABEABEQUOSEH,L1MFE0.74
ABEABEQUOSEH1MFA0.74
ABEABEQUOSEA,B,C2J600.74
ABEABEQUOSEH1MFC0.74
ABEABEQUOSEH1MFD0.74
ABEABEQUOSEH1MFB0.74
ABEABEQUOSEA1TYX0.74
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B2FAF0.71
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B,C,D2FAH0.71
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B2QZY0.71
AD0DIGALACTURONIC ACIDA,B2UVF0.86
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.81