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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00011432

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.86
R525-O-phosphono-D-riboseA,B,C,D,E2VVP0.79
AOSD-ALLOSEA,B,C,D2I570.81
GCOGLUCONIC ACIDB,C,D1BGG0.72
GCOGLUCONIC ACIDA,B1XLF0.72
ICTISOCITRIC ACIDA1IDE0.71
ICTISOCITRIC ACIDA,B2UXR0.71
ICTISOCITRIC ACIDA,B1XKD0.71
ICTISOCITRIC ACIDA8ICD0.71
ICTISOCITRIC ACIDA,B,D1XG40.71
ICTISOCITRIC ACIDA1CW70.71
ICTISOCITRIC ACIDA1GRO0.71
ICTISOCITRIC ACIDA1W8G0.71
ICTISOCITRIC ACIDA5ICD0.71
ICTISOCITRIC ACIDA,B1LWD0.71
ICTISOCITRIC ACIDA,B,C,D1ITW0.71
ICTISOCITRIC ACIDA,B,C,D1T0L0.71
ICTISOCITRIC ACIDA1PB10.71
ICTISOCITRIC ACIDA1GRP0.71
ICTISOCITRIC ACIDA1CW10.71
ICTISOCITRIC ACIDA,B,C,D,E,F2QFW0.71
ICTISOCITRIC ACIDA1B0J0.71
ICTISOCITRIC ACIDA1W7F0.71
ICTISOCITRIC ACIDA7ACN0.71
ICTISOCITRIC ACIDA1C970.71
ICTISOCITRIC ACIDA1P8F0.71
ICTISOCITRIC ACIDA2CSG0.71
3HG3-HYDROXYPENTANEDIOIC ACIDA,B,C,D,E,F2CW60.77
DNOD-mannoseA3BDK0.81
RNSL-RHAMNOSEA,B,C,D1X8D0.84
RNSL-RHAMNOSEA,B,C,D1DE60.84
RNSL-RHAMNOSEA,B,C,D2I560.84
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.7
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.7
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.7
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.7
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.7
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.7
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.72
XLSD-XYLOSE (LINEAR FORM)A,B2QW50.93
XLSD-XYLOSE (LINEAR FORM)A2BRP0.93
XLSD-XYLOSE (LINEAR FORM)A3XIS0.93
XLSD-XYLOSE (LINEAR FORM)A,B,C,D8XIM0.93
XLSD-XYLOSE (LINEAR FORM)A4XIS0.93
XLSD-XYLOSE (LINEAR FORM)A,B,C,D9XIM0.93
XLSD-XYLOSE (LINEAR FORM)A,B,C,D5XIN0.93
XLSD-XYLOSE (LINEAR FORM)A8XIA0.93
XLSD-XYLOSE (LINEAR FORM)A,B,C,D6XIM0.93
XLSD-XYLOSE (LINEAR FORM)A1XIC0.93
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.71
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.71
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.71
FUDD-fructoseA,B,C,D2QUN0.78
LGTL-GLUCARIC ACIDA,B,C,D3CB30.71
LGTL-GLUCARIC ACIDA,B,C2PP30.71
E4PERYTHOSE-4-PHOSPHATEA,B1NGS0.74
E4PERYTHOSE-4-PHOSPHATEA,B1U0G0.74
E4PERYTHOSE-4-PHOSPHATEA,B1FWT0.74
E4PERYTHOSE-4-PHOSPHATEA,B1RZM0.74
E4PERYTHOSE-4-PHOSPHATEA,B,C,D1IRI0.74
THETHREONATE IONA1XIJ0.7
TAGD-tagatoseA,B,C,D2QUM0.78
DMV2,3-DIHYDROXY-VALERIANIC ACIDA,B,C,D1QMG0.71
CS2D-MANNONIC ACIDA,B,C,D2QJM0.72
CS2D-MANNONIC ACIDA,B3DBN0.72
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.71
LI52-HYDROXY-4,5-DIOXOHEPTYL HYDROGEN PHOSPHONATEA,B1YCD0.7
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.72
GKRD-GLUCARATEA3CXT0.71
GKRD-GLUCARATEA,B1JCT0.71
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEB,C,D,E,F,G,H3GK00.71
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,E,F,G1M5W0.71
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,D1IXN0.71
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B1Q0Q0.71
XULD-XYLULOSEA3CWH0.79
XULD-XYLULOSEA1XII0.79
XULD-XYLULOSEA,B2ITM0.79
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.72
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.81
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.81
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.81
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.81
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.81
GLOD-GLUCOSE IN LINEAR FORMA1AC00.81
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.81
GAQ5-HYDROXYPENTANALA,B1ZLP0.76