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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02438139

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.77
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.77
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.77
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.77
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.77
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.77
GKRD-GLUCARATEA3CXT0.77
GKRD-GLUCARATEA,B1JCT0.77
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.71
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEB,C,D,E,F,G,H3GK00.75
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,E,F,G1M5W0.75
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,D1IXN0.75
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B1Q0Q0.75
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.72
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.72
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.76
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.76
P6T1,6-di-O-phosphono-D-tagatoseA,B3GAY0.7
AOSD-ALLOSEA,B,C,D2I570.88
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H0.71
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT0.71
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX0.71
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL0.71
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO0.71
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M0.71
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
M1E6X0.72
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B2E400.72
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A2VWG0.72
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B3EQO0.72
RNSL-RHAMNOSEA,B,C,D1X8D0.96
RNSL-RHAMNOSEA,B,C,D1DE60.96
RNSL-RHAMNOSEA,B,C,D2I560.96
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.7
DNOD-mannoseA3BDK0.88
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.75
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.75
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.77
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.82
DMV2,3-DIHYDROXY-VALERIANIC ACIDA,B,C,D1QMG0.71
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.79
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.81
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.81
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.81
GCOGLUCONIC ACIDB,C,D1BGG0.79
GCOGLUCONIC ACIDA,B1XLF0.79
LI52-HYDROXY-4,5-DIOXOHEPTYL HYDROGEN PHOSPHONATEA,B1YCD0.7
TAGD-tagatoseA,B,C,D2QUM0.82
KDP2-KETO-DEOXY-GALACTOSEA2V820.71
E4PERYTHOSE-4-PHOSPHATEA,B1NGS0.71
E4PERYTHOSE-4-PHOSPHATEA,B1U0G0.71
E4PERYTHOSE-4-PHOSPHATEA,B1FWT0.71
E4PERYTHOSE-4-PHOSPHATEA,B1RZM0.71
E4PERYTHOSE-4-PHOSPHATEA,B,C,D1IRI0.71
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.81
FUDD-fructoseA,B,C,D2QUN0.82
I22D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATEB2I220.72
XLSD-XYLOSE (LINEAR FORM)A,B2QW50.87
XLSD-XYLOSE (LINEAR FORM)A2BRP0.87
XLSD-XYLOSE (LINEAR FORM)A3XIS0.87
XLSD-XYLOSE (LINEAR FORM)A,B,C,D8XIM0.87
XLSD-XYLOSE (LINEAR FORM)A4XIS0.87
XLSD-XYLOSE (LINEAR FORM)A,B,C,D9XIM0.87
XLSD-XYLOSE (LINEAR FORM)A,B,C,D5XIN0.87
XLSD-XYLOSE (LINEAR FORM)A8XIA0.87
XLSD-XYLOSE (LINEAR FORM)A,B,C,D6XIM0.87
XLSD-XYLOSE (LINEAR FORM)A1XIC0.87
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.79
LGTL-GLUCARIC ACIDA,B,C,D3CB30.77
LGTL-GLUCARIC ACIDA,B,C2PP30.77
XULD-XYLULOSEA3CWH0.79
XULD-XYLULOSEA1XII0.79
XULD-XYLULOSEA,B2ITM0.79
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.88
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.88
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.88
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.88
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.88
GLOD-GLUCOSE IN LINEAR FORMA1AC00.88
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.88
CS2D-MANNONIC ACIDA,B,C,D2QJM0.79
CS2D-MANNONIC ACIDA,B3DBN0.79
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.75
R525-O-phosphono-D-riboseA,B,C,D,E2VVP0.75
P6F1,6-di-O-phosphono-D-fructoseA,B3GB60.7