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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02214120

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DLGHEXYL 3-DEOXY-BETA-D-GALACTOPYRANOSEA1WT20.72
DLGHEXYL 3-DEOXY-BETA-D-GALACTOPYRANOSEA1R7T0.72
DLGHEXYL 3-DEOXY-BETA-D-GALACTOPYRANOSEA1R7U0.72
HSUbeta-D-ribofuranoseA,B1QXB0.73
FRUFRUCTOSEA1FIT0.75
FRUFRUCTOSEA,B,C,D,E,F,
G,H,S,T
3B750.75
FRUFRUCTOSEA,B,C1AF60.75
FRUFRUCTOSEA,B,C2INV0.75
FRUFRUCTOSEA1Y9G0.75
FRUFRUCTOSEA2O510.75
FRUFRUCTOSEA,B1N3P0.75
FRUFRUCTOSEA,B,C,D2HK10.75
FRUFRUCTOSEB,C,F,H,I,K,L2DD40.75
FRUFRUCTOSEA,B,C,D2I580.75
FRUFRUCTOSEA,C1LES0.75
FRUFRUCTOSEA2ADE0.75
FRUFRUCTOSEA,B3BRQ0.75
FRUFRUCTOSEA2HW10.75
FRUFRUCTOSEA2FIT0.75
FRUFRUCTOSEA3FIT0.75
FRUFRUCTOSEA,B1N3Q0.75
FRUFRUCTOSEA2DWJ0.75
AI23A-METHYL-5,6-DIHYDRO-FURO[2,3-
D][1,3,2]DIOXABOROLE-2,2,6,6A-TETRAOL
A,B2HJ90.73
AI23A-METHYL-5,6-DIHYDRO-FURO[2,3-
D][1,3,2]DIOXABOROLE-2,2,6,6A-TETRAOL
A1JX60.73
PAV(2R,4S)-2-METHYL-2,3,3,4-TETRAHYDROXYTETRAHYDROFURANA,B3EJW0.8
PAV(2R,4S)-2-METHYL-2,3,3,4-TETRAHYDROXYTETRAHYDROFURANA1TJY0.8
MDA2,6-DIDEOXY-3 C-METHYL-D-RIBOPYRANOSIDEA,B146D0.74
MDA2,6-DIDEOXY-3 C-METHYL-D-RIBOPYRANOSIDEA,B207D0.74
MDA2,6-DIDEOXY-3 C-METHYL-D-RIBOPYRANOSIDEA,B1BP80.74
LRH6-DEOXY-BETA-L-FRUCTOFURANOSEA2UYT0.77
DFR3-DEOXY-3-METHYL-D-FRUCTOSEA9XIA0.8
KHO4-(3,4-DIHYDROXY-5-HYDROXYMETHYL-
TETRAHYDRO-FURAN-2-YLOXY)-TETRAHYDRO-
PYRAN-2,3,5-TRIOL
A,B1QW80.73
BDRBETA-D-RIBOFURANOSYLA1NEM0.73
GZLBETA-D-GALACTOFURANOSEA2VK20.72
H1Mmethyl 2-deoxy-2-(2-hydroxyethyl)-
alpha-D-mannopyranoside
A,B,C,D3D4K0.71
OPMO1-PENTYL-MANNOSEA,B3GXY0.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D1YQ30.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A1LZI0.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,E,F,
G,N,O,P,Q,R,
S,T
1PP90.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B2GMH0.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,E,F,
G,O,P,Q,R,S,T
1PPJ0.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A1WT10.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A1WT30.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A1LZJ0.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,E,F,
G,I,N,O,P,Q,
R,S,T,U,V,W
2A060.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,N,O,
P,Q
2FBW0.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D1YQ40.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D2H890.72
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,N,O,
P,Q
2H880.72
LFRBETA-L-FRUCTO-FURANOSEA2CGJ0.75
LFRBETA-L-FRUCTO-FURANOSEA2CGL0.75
LFRBETA-L-FRUCTO-FURANOSEA1ZX50.75
RIBRIBOSEA1RKD0.73
RIBRIBOSEA1QD30.73
RIBRIBOSEA,B2C400.73
RIBRIBOSEA1RKS0.73
RIBRIBOSEA4RHN0.73
RIBRIBOSEA,B,C,D1GQT0.73
RIBRIBOSEA,B,C,D1RK20.73
RIBRIBOSEA1YOE0.73
FUBbeta-L-arabinofuranoseA3D610.73
FUBbeta-L-arabinofuranoseA3D5Z0.73
ERI4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-
BETA-L-ARABINO-HEXOPYRANOSE
A,B1D830.72
ERI4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-
BETA-L-ARABINO-HEXOPYRANOSE
A,B1EKH0.72
ERI4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-
BETA-L-ARABINO-HEXOPYRANOSE
A,B1EKI0.72
ERI4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-
BETA-L-ARABINO-HEXOPYRANOSE
A,B,C,D1VAQ0.72
AHRALPHA-L-ARABINOFURANOSEA2D440.73
AHRALPHA-L-ARABINOFURANOSEA,B,C2VRQ0.73
AHRALPHA-L-ARABINOFURANOSEA,B1PZ20.73
AHRALPHA-L-ARABINOFURANOSEA,B1V6U0.73
AHRALPHA-L-ARABINOFURANOSEA1UR10.73
AHRALPHA-L-ARABINOFURANOSEA3D610.73
AHRALPHA-L-ARABINOFURANOSEA2D430.73
AHRALPHA-L-ARABINOFURANOSEA,B,C,D,E,F2C7F0.73
AHRALPHA-L-ARABINOFURANOSEA1UR20.73
AHRALPHA-L-ARABINOFURANOSEA,B,C,D,E,F2C8N0.73
AHRALPHA-L-ARABINOFURANOSEA3D5Z0.73
AHRALPHA-L-ARABINOFURANOSEA2CNC0.73
AHRALPHA-L-ARABINOFURANOSEA2BNJ0.73
AHRALPHA-L-ARABINOFURANOSEA2W5O0.73
AHRALPHA-L-ARABINOFURANOSEA,B1V6V0.73
AHRALPHA-L-ARABINOFURANOSEA1WD40.73
AHRALPHA-L-ARABINOFURANOSEB1GYE0.73
SUCSUCROSEA,C,D,E,L,N,
O,P,W
3CX50.72
SUCSUCROSEA,B1JCQ0.72
SUCSUCROSEA1ZS20.72
SUCSUCROSEA,B,C,D,E,F2HVH0.72
SUCSUCROSEA,B2IEJ0.72
SUCSUCROSEA2C560.72
SUCSUCROSEA,D2NY60.72
SUCSUCROSEA,B,C2HRR0.72
SUCSUCROSEA,C1XC90.72
SUCSUCROSEP,Q,R1A0T0.72
SUCSUCROSEA,B2BE20.72
SUCSUCROSEA1MW30.72
SUCSUCROSEA,B,C,D1MV80.72
SUCSUCROSEA1MW20.72
SUCSUCROSEA,C2HHV0.72
SUCSUCROSEA1NK40.72
SUCSUCROSEA,B,C,D3H830.72
SUCSUCROSEA1L3T0.72
SUCSUCROSEA,D2NY10.72
SUCSUCROSEA2QQV0.72
SUCSUCROSEA,C2HHX0.72
SUCSUCROSEA1NJY0.72
SUCSUCROSEA2GUP0.72
SUCSUCROSEA,B,P2H6F0.72
SUCSUCROSEA,C,D,E,L,N,
O,P,W
3CXH0.72
SUCSUCROSEA,C1U490.72
SUCSUCROSEA,B,C1V8X0.72
SUCSUCROSEA,B,C1IW10.72
SUCSUCROSEA,B1MJT0.72
SUCSUCROSEA,C,D1RZG0.72
SUCSUCROSEA,B,D,E2HVI0.72
SUCSUCROSEA,C2HW30.72
SUCSUCROSEA,B1EX20.72
SUCSUCROSEA1NKB0.72
SUCSUCROSEA,B1X3W0.72
SUCSUCROSEA,B1M980.72
SUCSUCROSEA1NKC0.72
SUCSUCROSEA,D2NY30.72
SUCSUCROSEA,B3HP80.72
SUCSUCROSEA,I1X3Z0.72
SUCSUCROSEA1NKE0.72
SUCSUCROSEA,B1YNP0.72
SUCSUCROSEA1L5U0.72
SUCSUCROSEA,B2HHS0.72
SUCSUCROSEA,B1FE40.72
SUCSUCROSEA,B1L0G0.72
SUCSUCROSEA1L3U0.72
SUCSUCROSEA2OXB0.72
SUCSUCROSEA,B,C1IW00.72
SUCSUCROSEA,B1LD80.72
SUCSUCROSEB1MZC0.72
SUCSUCROSEA,B2GDU0.72
SUCSUCROSEA2ADD0.72
SUCSUCROSE11R1A0.72
SUCSUCROSEA1JJ00.72
SUCSUCROSEB1S630.72
SUCSUCROSEA,B,C,D2NXZ0.72
SUCSUCROSEA1TJ40.72
SUCSUCROSEA,D2NY40.72
SUCSUCROSEA,C1OFS0.72
SUCSUCROSEA,C2HHU0.72
SUCSUCROSEA,B1UC20.72
SUCSUCROSEA1NK90.72
SUCSUCROSEA,C1UA00.72
SUCSUCROSEA1YLJ0.72
SUCSUCROSEA2QQU0.72
SUCSUCROSEA,B1YNQ0.72
SUCSUCROSEA1L3V0.72
SUCSUCROSEA,B1TN60.72
SUCSUCROSEA1NJZ0.72
SUCSUCROSEA,B,C,D1MUU0.72
SUCSUCROSEA1NK60.72
SUCSUCROSEA2DVC0.72
SUCSUCROSEA1QZ60.72
SUCSUCROSEA1MW10.72
SUCSUCROSEA,B,C,D,E,F2HHW0.72
SUCSUCROSEB1LD70.72
SUCSUCROSEA1NK80.72
SUCSUCROSEA1NK70.72
SUCSUCROSEP,Q,R1OH20.72
SUCSUCROSEA,C2HHT0.72
SUCSUCROSEA,B,P2H6H0.72
SUCSUCROSEA,B,C,D,E,F2HRQ0.72
SUCSUCROSEB,P2H6I0.72
SUCSUCROSEA,B2HHQ0.72
SUCSUCROSEB,P2H6G0.72
SUCSUCROSEA,C1U450.72
SUCSUCROSEA1PT20.72
SUCSUCROSEA1JGI0.72
SUCSUCROSEA1NK00.72
SUCSUCROSEA,B1FE00.72
SUCSUCROSEA,B,C,D,E,F1W2T0.72
SUCSUCROSEA3CZK0.72
SUCSUCROSEA,C1U470.72
SUCSUCROSEA,B1GNX0.72
SUCSUCROSEA,B2PWE0.72
SUCSUCROSEA1NJX0.72
SUCSUCROSEA1YLP0.72
SUCSUCROSEA2QQW0.72
SUCSUCROSEA,B1OB20.72
SUCSUCROSEA,C1U480.72
SUCSUCROSEA1L3S0.72
SUCSUCROSEB1SA40.72
SUCSUCROSEA1TJ50.72
SUCSUCROSEA,B2I5J0.72
SUCSUCROSEA1NJW0.72
SUCSUCROSEA,C1U4B0.72
SUCSUCROSEA,B1FEE0.72
SUCSUCROSEG,H2NY50.72
SUCSUCROSEA,B2PR10.72
SUCSUCROSEB3E370.72
SUCSUCROSEA,B2HDS0.72
SUCSUCROSEA1NK50.72
SUCSUCROSEA1YLT0.72
SUCSUCROSEA,B,C,D,E,F,
G,H,I
1XLT0.72
SUCSUCROSEA,D2NY20.72
XLFbeta-D-xylulofuranoseA,B3CTP0.76
DEGBUTYL ALPHA-D-MANNOPYRANOSIDEA1UWF0.72
DEGBUTYL ALPHA-D-MANNOPYRANOSIDEA,B1TR70.72