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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813265

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GKRD-GLUCARATEA3CXT0.77
GKRD-GLUCARATEA,B1JCT0.77
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.71
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.74
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
OOA3-OXOOCTANOIC ACIDA,B,C,D1H0M0.73
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
FUDD-fructoseA,B,C,D2QUN0.75
KPLKETOPANTOATEA,B,C,D,E,F,
G,H,I,J
1M3U0.7
HOC(2S)-2-HYDROXYOCTANOIC ACIDA2A850.76
TAGD-tagatoseA,B,C,D2QUM0.75
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.77
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.75
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.88
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.73
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.7
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.7
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.7
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.7
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.7
GLOD-GLUCOSE IN LINEAR FORMA1AC00.7
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.7
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
DSB4,7-DIOXOSEBACIC ACIDA,B1I8J0.75
DSB4,7-DIOXOSEBACIC ACIDA1EB30.75
DSB4,7-DIOXOSEBACIC ACIDA,B1L6S0.75
DSB4,7-DIOXOSEBACIC ACIDA,B2C1H0.75
GCOGLUCONIC ACIDB,C,D1BGG0.79
GCOGLUCONIC ACIDA,B1XLF0.79
SHU4,6-DIOXOHEPTANOIC ACIDA1H7R0.75
AOSD-ALLOSEA,B,C,D2I570.7
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.72
KDP2-KETO-DEOXY-GALACTOSEA2V820.71
KD03-deoxy-8-O-phosphono-D-manno-oct-
2-ulosonic acid
A,B3E120.74
DNOD-mannoseA3BDK0.7
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA2FCP0.72
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA1FCP0.72
BFC(R)-3-HYDROXYTETRADECANALA2NPV0.71
PMLPIMELIC ACIDA1KGT0.73
DQA1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACIDA1J2Y0.74
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.78
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.78
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.78
LGTL-GLUCARIC ACIDA,B,C,D3CB30.77
LGTL-GLUCARIC ACIDA,B,C2PP30.77
LIM3-OXO-PENTADECANOIC ACIDA2FCP0.72
LIM3-OXO-PENTADECANOIC ACIDA1UJW0.72
LIM3-OXO-PENTADECANOIC ACIDA1FCP0.72
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.78
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.73
4OX4-OXODECANEDIOIC ACIDA1GJP0.73
CS2D-MANNONIC ACIDA,B,C,D2QJM0.79
CS2D-MANNONIC ACIDA,B3DBN0.79
XULD-XYLULOSEA3CWH0.71
XULD-XYLULOSEA1XII0.71
XULD-XYLULOSEA,B2ITM0.71
THETHREONATE IONA1XIJ0.71
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.75