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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03089454

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BEMbeta-D-mannuronic acidA2ZAA0.77
BEMbeta-D-mannuronic acidA2ZAC0.77
BEMbeta-D-mannuronic acidA2ZAB0.77
BEMbeta-D-mannuronic acidA1Y3N0.77
BEMbeta-D-mannuronic acidA1Y3P0.77
BEMbeta-D-mannuronic acidA,B1J1N0.77
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.78
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NST0.81
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NSP0.81
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT90.81
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTQ0.81
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTP0.81
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT60.81
XLSD-XYLOSE (LINEAR FORM)A,B2QW50.72
XLSD-XYLOSE (LINEAR FORM)A2BRP0.72
XLSD-XYLOSE (LINEAR FORM)A3XIS0.72
XLSD-XYLOSE (LINEAR FORM)A,B,C,D8XIM0.72
XLSD-XYLOSE (LINEAR FORM)A4XIS0.72
XLSD-XYLOSE (LINEAR FORM)A,B,C,D9XIM0.72
XLSD-XYLOSE (LINEAR FORM)A,B,C,D5XIN0.72
XLSD-XYLOSE (LINEAR FORM)A8XIA0.72
XLSD-XYLOSE (LINEAR FORM)A,B,C,D6XIM0.72
XLSD-XYLOSE (LINEAR FORM)A1XIC0.72
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWG0.79
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWF0.79
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWH0.79
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.89
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.82
TAGD-tagatoseA,B,C,D2QUM0.85
KO1D-glycero-alpha-D-talo-oct-2-ulopyranosonic acidA,B2R230.73
KBG2-KETO-BETA-D-GLUCOSEA2F5V0.78
KBG2-KETO-BETA-D-GLUCOSEA1FQ70.78
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.79
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.79
LGTL-GLUCARIC ACIDA,B,C,D3CB30.8
LGTL-GLUCARIC ACIDA,B,C2PP30.8
XULD-XYLULOSEA3CWH0.75
XULD-XYLULOSEA1XII0.75
XULD-XYLULOSEA,B2ITM0.75
FUDD-fructoseA,B,C,D2QUN0.85
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.74
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.74
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.74
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.74
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.74
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.74
DG04-O-alpha-D-galactopyranuronosyl-
alpha-D-galactopyranuronic acid
A3DYB0.72
IDSO2-SULFO-GLUCURONIC ACID11ZBA0.72
IDSO2-SULFO-GLUCURONIC ACIDA2HYV0.72
IDSO2-SULFO-GLUCURONIC ACIDA1BFC0.72
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D2VRA0.72
IDSO2-SULFO-GLUCURONIC ACIDH,I3B9F0.72
IDSO2-SULFO-GLUCURONIC ACIDB,C,D,E1E0O0.72
IDSO2-SULFO-GLUCURONIC ACIDA2HYU0.72
IDSO2-SULFO-GLUCURONIC ACIDA,B3DY00.72
IDSO2-SULFO-GLUCURONIC ACIDB2AXM0.72
IDSO2-SULFO-GLUCURONIC ACIDA,B1FQ90.72
IDSO2-SULFO-GLUCURONIC ACIDA1BFB0.72
IDSO2-SULFO-GLUCURONIC ACIDA,B1T8U0.72
IDSO2-SULFO-GLUCURONIC ACIDA,B1GMN0.72
IDSO2-SULFO-GLUCURONIC ACIDA1XT30.72
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D,E,F1AXM0.72
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D,E,F,
G,H
1GMO0.72
IDSO2-SULFO-GLUCURONIC ACIDA2ERM0.72
IDSO2-SULFO-GLUCURONIC ACIDB,D,F,H1XMN0.72
IDSO2-SULFO-GLUCURONIC ACIDA1HPN0.72
IDSO2-SULFO-GLUCURONIC ACIDA1G5N0.72
IDSO2-SULFO-GLUCURONIC ACID11QQP0.72
IDSO2-SULFO-GLUCURONIC ACIDA,B1RID0.72
P6T1,6-di-O-phosphono-D-tagatoseA,B3GAY0.73
DNOD-mannoseA3BDK0.83
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.84
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.84
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
M1E6X0.84
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B2E400.84
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A2VWG0.84
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B3EQO0.84
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.83
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.77
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.77
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.77
AOSD-ALLOSEA,B,C,D2I570.83
GCUD-GLUCURONIC ACIDA1HMW0.77
GCUD-GLUCURONIC ACIDA2JCQ0.77
GCUD-GLUCURONIC ACIDA3HYA0.77
GCUD-GLUCURONIC ACIDA,B2FUQ0.77
GCUD-GLUCURONIC ACIDA1DBG0.77
GCUD-GLUCURONIC ACIDA1FCV0.77
GCUD-GLUCURONIC ACIDA1OFM0.77
GCUD-GLUCURONIC ACIDA,B3E7J0.77
GCUD-GLUCURONIC ACIDA1CB80.77
GCUD-GLUCURONIC ACIDA1HV60.77
GCUD-GLUCURONIC ACIDA1HMU0.77
GCUD-GLUCURONIC ACIDA,B,C3E800.77
GCUD-GLUCURONIC ACIDA,B2VZR0.77
GCUD-GLUCURONIC ACIDA2HYA0.77
GCUD-GLUCURONIC ACIDA1OFL0.77
GCUD-GLUCURONIC ACIDA,B2W870.77
GCUD-GLUCURONIC ACIDA1MQQ0.77
GCUD-GLUCURONIC ACIDA1HM20.77
GCUD-GLUCURONIC ACIDA1HYA0.77
GCUD-GLUCURONIC ACIDA2C4S0.77
GCUD-GLUCURONIC ACIDA4HYA0.77
GCUD-GLUCURONIC ACIDA1C4S0.77
GCUD-GLUCURONIC ACIDA1HM30.77
GCUD-GLUCURONIC ACIDA1DBO0.77
KDP2-KETO-DEOXY-GALACTOSEA2V820.74
IDX2-O-sulfo-alpha-L-gulopyranuronic acid11QQP0.72
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
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDH,I1TB60.79
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDA,B,D,I2B5T0.79
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.83
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.83
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.83
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.83
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.83
GLOD-GLUCOSE IN LINEAR FORMA1AC00.83
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.83
KDF3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acidA,B,C2VAR0.74
GTRGALACTURONIC ACIDA1KCD0.77
GTRGALACTURONIC ACIDA1KCC0.77
GTRGALACTURONIC ACIDA1N7Q0.77
RNSL-RHAMNOSEA,B,C,D1X8D0.8
RNSL-RHAMNOSEA,B,C,D1DE60.8
RNSL-RHAMNOSEA,B,C,D2I560.8
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.84
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.84
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.84
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.8
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9E0.79
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6X0.79
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1UQZ0.79
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1H410.79
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9F0.79
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6W0.79
MAVD-MANNURONIC ACIDA,B1J1N0.77
MAVD-MANNURONIC ACIDA1Y3P0.77
MAVD-MANNURONIC ACIDA,B,D2PYH0.77
MAVD-MANNURONIC ACIDA1Y3N0.77
MAVD-MANNURONIC ACIDA1HV60.77
P6F1,6-di-O-phosphono-D-fructoseA,B3GB60.73
GCW4-O-METHYL-BETA-D-GLUCURONIC ACIDA1L8N0.79
IDRL-IDURONIC ACIDA2V380.77
IDRL-IDURONIC ACIDA1HM20.77
IDRL-IDURONIC ACIDA2ERM0.77
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.78
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.73
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.73
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.73
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.73
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.73
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.73
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.73
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.73
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.73
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.73
CS2D-MANNONIC ACIDA,B,C,D2QJM0.82
CS2D-MANNONIC ACIDA,B3DBN0.82
I22D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATEB2I220.75
IDU2-O-sulfo-beta-L-altropyranuronic acidA,B2BRS0.72
IDU2-O-sulfo-beta-L-altropyranuronic acidA,B1FQ90.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.77
SHBmethyl beta-D-galactopyranuronateC,D2NTP0.81
DQA1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACIDA1J2Y0.74
LGUALPHA-L-GULURONATEA2ZAC0.77
LGUALPHA-L-GULURONATEA2ZAA0.77
LGUALPHA-L-GULURONATEA,B2QJR0.77
LGUALPHA-L-GULURONATEA2ZAB0.77
LGUALPHA-L-GULURONATEA,B1J1N0.77
LGUALPHA-L-GULURONATEA1Y3P0.77
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDA,B,D,I2B5T0.79
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDH,I1TB60.79
AD0DIGALACTURONIC ACIDA,B2UVF0.72
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.92
GCOGLUCONIC ACIDB,C,D1BGG0.82
GCOGLUCONIC ACIDA,B1XLF0.82
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.73
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.73
GKRD-GLUCARATEA3CXT0.8
GKRD-GLUCARATEA,B1JCT0.8
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