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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03131633

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BEMbeta-D-mannuronic acidA2ZAA0.72
BEMbeta-D-mannuronic acidA2ZAC0.72
BEMbeta-D-mannuronic acidA2ZAB0.72
BEMbeta-D-mannuronic acidA1Y3N0.72
BEMbeta-D-mannuronic acidA1Y3P0.72
BEMbeta-D-mannuronic acidA,B1J1N0.72
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9E0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6X0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1UQZ0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1H410.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9F0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6W0.7
GCW4-O-METHYL-BETA-D-GLUCURONIC ACIDA1L8N0.7
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.96
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.96
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.96
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.96
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.96
GLOD-GLUCOSE IN LINEAR FORMA1AC00.96
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.96
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
M1E6X0.78
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B2E400.78
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A2VWG0.78
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B3EQO0.78
GCOGLUCONIC ACIDB,C,D1BGG0.86
GCOGLUCONIC ACIDA,B1XLF0.86
TAGD-tagatoseA,B,C,D2QUM0.85
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.78
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.78
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.79
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.79
XULD-XYLULOSEA3CWH0.75
XULD-XYLULOSEA1XII0.75
XULD-XYLULOSEA,B2ITM0.75
FUDD-fructoseA,B,C,D2QUN0.85
GKRD-GLUCARATEA3CXT0.84
GKRD-GLUCARATEA,B1JCT0.84
P6T1,6-di-O-phosphono-D-tagatoseA,B3GAY0.73
CS2D-MANNONIC ACIDA,B,C,D2QJM0.86
CS2D-MANNONIC ACIDA,B3DBN0.86
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.76
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.9
SORD-SORBITOLA1FQA0.71
SORD-SORBITOLA,B,C,D3XIM0.71
SORD-SORBITOLA2VFT0.71
SORD-SORBITOLA,B,C,D5XIM0.71
SORD-SORBITOLA3BRF0.71
SORD-SORBITOLA1XIH0.71
SORD-SORBITOLA2DXR0.71
SORD-SORBITOLA1D8C0.71
SORD-SORBITOLA,B,C,D2XIN0.71
SORD-SORBITOLA1FQB0.71
SORD-SORBITOLA,B4XIA0.71
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWG0.8
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWF0.8
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWH0.8
GCUD-GLUCURONIC ACIDA1HMW0.72
GCUD-GLUCURONIC ACIDA2JCQ0.72
GCUD-GLUCURONIC ACIDA3HYA0.72
GCUD-GLUCURONIC ACIDA,B2FUQ0.72
GCUD-GLUCURONIC ACIDA1DBG0.72
GCUD-GLUCURONIC ACIDA1FCV0.72
GCUD-GLUCURONIC ACIDA1OFM0.72
GCUD-GLUCURONIC ACIDA,B3E7J0.72
GCUD-GLUCURONIC ACIDA1CB80.72
GCUD-GLUCURONIC ACIDA1HV60.72
GCUD-GLUCURONIC ACIDA1HMU0.72
GCUD-GLUCURONIC ACIDA,B,C3E800.72
GCUD-GLUCURONIC ACIDA,B2VZR0.72
GCUD-GLUCURONIC ACIDA2HYA0.72
GCUD-GLUCURONIC ACIDA1OFL0.72
GCUD-GLUCURONIC ACIDA,B2W870.72
GCUD-GLUCURONIC ACIDA1MQQ0.72
GCUD-GLUCURONIC ACIDA1HM20.72
GCUD-GLUCURONIC ACIDA1HYA0.72
GCUD-GLUCURONIC ACIDA2C4S0.72
GCUD-GLUCURONIC ACIDA4HYA0.72
GCUD-GLUCURONIC ACIDA1C4S0.72
GCUD-GLUCURONIC ACIDA1HM30.72
GCUD-GLUCURONIC ACIDA1DBO0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.72
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.72
KDP2-KETO-DEOXY-GALACTOSEA2V820.74
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.84
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.73
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.73
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.73
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.73
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.73
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.73
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.73
GC44-DEOXY-D-GLUCURONIC ACIDA1I8Q0.74
GC44-DEOXY-D-GLUCURONIC ACIDA1C4S0.74
GC44-DEOXY-D-GLUCURONIC ACIDA1DBO0.74
R525-O-phosphono-D-riboseA,B,C,D,E2VVP0.72
GTRGALACTURONIC ACIDA1KCD0.72
GTRGALACTURONIC ACIDA1KCC0.72
GTRGALACTURONIC ACIDA1N7Q0.72
LGTL-GLUCARIC ACIDA,B,C,D3CB30.84
LGTL-GLUCARIC ACIDA,B,C2PP30.84
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.84
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.84
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.84
MAVD-MANNURONIC ACIDA,B1J1N0.72
MAVD-MANNURONIC ACIDA1Y3P0.72
MAVD-MANNURONIC ACIDA,B,D2PYH0.72
MAVD-MANNURONIC ACIDA1Y3N0.72
MAVD-MANNURONIC ACIDA1HV60.72
IDRL-IDURONIC ACIDA2V380.72
IDRL-IDURONIC ACIDA1HM20.72
IDRL-IDURONIC ACIDA2ERM0.72
P6F1,6-di-O-phosphono-D-fructoseA,B3GB60.73
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.75
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.75
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.75
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.75
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.75
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.77
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.86
XLSD-XYLOSE (LINEAR FORM)A,B2QW50.83
XLSD-XYLOSE (LINEAR FORM)A2BRP0.83
XLSD-XYLOSE (LINEAR FORM)A3XIS0.83
XLSD-XYLOSE (LINEAR FORM)A,B,C,D8XIM0.83
XLSD-XYLOSE (LINEAR FORM)A4XIS0.83
XLSD-XYLOSE (LINEAR FORM)A,B,C,D9XIM0.83
XLSD-XYLOSE (LINEAR FORM)A,B,C,D5XIN0.83
XLSD-XYLOSE (LINEAR FORM)A8XIA0.83
XLSD-XYLOSE (LINEAR FORM)A,B,C,D6XIM0.83
XLSD-XYLOSE (LINEAR FORM)A1XIC0.83
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.72
I22D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATEB2I220.75
LGUALPHA-L-GULURONATEA2ZAC0.72
LGUALPHA-L-GULURONATEA2ZAA0.72
LGUALPHA-L-GULURONATEA,B2QJR0.72
LGUALPHA-L-GULURONATEA2ZAB0.72
LGUALPHA-L-GULURONATEA,B1J1N0.72
LGUALPHA-L-GULURONATEA1Y3P0.72
DNOD-mannoseA3BDK0.96
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.79
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.86
KDF3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acidA,B,C2VAR0.77
RNSL-RHAMNOSEA,B,C,D1X8D0.88
RNSL-RHAMNOSEA,B,C,D1DE60.88
RNSL-RHAMNOSEA,B,C,D2I560.88
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.83
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.83
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.83
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.83
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.83
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.83
MTLD-MANNITOLA,B1ZZU0.71
MTLD-MANNITOLA,B1ZZQ0.71
MTLD-MANNITOLA,B1M2W0.71
MTLD-MANNITOLA2VFU0.71
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.9
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.88
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H0.75
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT0.75
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX0.75
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL0.75
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO0.75
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M0.75
AOSD-ALLOSEA,B,C,D2I570.96
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.75
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.75