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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03131650

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
P6F1,6-di-O-phosphono-D-fructoseA,B3GB60.82
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEL1RLC0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z		1IR20.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H		1RBL0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W		1UW90.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D4RUB0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G8RUC0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,D,E,H,K,
O,R,V		1UWA0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDH0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V630.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W		1UZD0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDI0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G,I,K,
M,O		1GK80.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V6A0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1UPP0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V690.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W		1UZH0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1BWV0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,E,S,W1WDD0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1UPM0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,S,T,
U,V		1IR10.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V670.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,L1RBO0.72
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V680.72
GCOGLUCONIC ACIDB,C,D1BGG0.72
GCOGLUCONIC ACIDA,B1XLF0.72
R525-O-phosphono-D-riboseA,B,C,D,E2VVP0.88
R105-O-phosphono-D-ribonic acidA,B,C,D,E2VVQ0.79
E4PERYTHOSE-4-PHOSPHATEA,B1NGS0.77
E4PERYTHOSE-4-PHOSPHATEA,B1U0G0.77
E4PERYTHOSE-4-PHOSPHATEA,B1FWT0.77
E4PERYTHOSE-4-PHOSPHATEA,B1RZM0.77
E4PERYTHOSE-4-PHOSPHATEA,B,C,D1IRI0.77
DG62-DEOXY-GLUCITOL-6-PHOSPHATEA,B1JKI0.71
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEB,C,D,E,F,G,H3GK00.74
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,E,F,G1M5W0.74
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,D1IXN0.74
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B1Q0Q0.74
DEZ4-PHOSPHO-D-ERYTHRONATEA,B,C,D,E2BET0.73
S6PD-SORBITOL-6-PHOSPHATEA,B2CXQ0.71
S6PD-SORBITOL-6-PHOSPHATEA,B1XTB0.71
S6PD-SORBITOL-6-PHOSPHATEA,B2GC10.71
S6PD-SORBITOL-6-PHOSPHATEA,B,C,D,E,F3CTL0.71
GKRD-GLUCARATEA3CXT0.74
GKRD-GLUCARATEA,B1JCT0.74
CKP(2R,3R,4S,5R)-2,3,4-TRIHYDROXY-
5-[(PHOSPHONATOOXY)METHYL]TETRAHYDROFURAN-
2-CARBOXYLIC ACID		A,B,C,D,E,F,
G,H,I,J,K,L		2DCN0.74
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.93
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.93
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.93
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.93
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.93
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.93
LI52-HYDROXY-4,5-DIOXOHEPTYL HYDROGEN PHOSPHONATEA,B1YCD0.8
AOSD-ALLOSEA,B,C,D2I570.8
KD03-deoxy-8-O-phosphono-D-manno-oct-
2-ulosonic acid		A,B3E120.76
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.71
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.71
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.71
XLSD-XYLOSE (LINEAR FORM)A,B2QW50.75
XLSD-XYLOSE (LINEAR FORM)A2BRP0.75
XLSD-XYLOSE (LINEAR FORM)A3XIS0.75
XLSD-XYLOSE (LINEAR FORM)A,B,C,D8XIM0.75
XLSD-XYLOSE (LINEAR FORM)A4XIS0.75
XLSD-XYLOSE (LINEAR FORM)A,B,C,D9XIM0.75
XLSD-XYLOSE (LINEAR FORM)A,B,C,D5XIN0.75
XLSD-XYLOSE (LINEAR FORM)A8XIA0.75
XLSD-XYLOSE (LINEAR FORM)A,B,C,D6XIM0.75
XLSD-XYLOSE (LINEAR FORM)A1XIC0.75
CS2D-MANNONIC ACIDA,B,C,D2QJM0.72
CS2D-MANNONIC ACIDA,B3DBN0.72
DNOD-mannoseA3BDK0.8
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.71
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.72
LGTL-GLUCARIC ACIDA,B,C,D3CB30.74
LGTL-GLUCARIC ACIDA,B,C2PP30.74
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.84
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.84
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.84
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.84
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.84
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.84
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.84
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.84
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.84
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.84
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.88
XBPXYLULOSE-1,5-BISPHOSPHATEA,B,C,D,E,F,
G,H		1RSC0.76
DERD-4-PHOSPHOERYTHRONIC ACIDA,B,C,D1LK70.73
DERD-4-PHOSPHOERYTHRONIC ACIDA,B2CXO0.73
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.8
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.8
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.8
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.8
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.8
GLOD-GLUCOSE IN LINEAR FORMA1AC00.8
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.8
PA55-PHOSPHOARABINONIC ACIDA1NUH0.79
PA55-PHOSPHOARABINONIC ACIDA1X820.79
PA55-PHOSPHOARABINONIC ACIDA,B1QXR0.79
PA55-PHOSPHOARABINONIC ACIDA,B1G980.79
PA55-PHOSPHOARABINONIC ACIDA,B1TZC0.79
PA55-PHOSPHOARABINONIC ACIDA1GZV0.79
PA55-PHOSPHOARABINONIC ACIDA1X7N0.79
PA55-PHOSPHOARABINONIC ACIDA1C7R0.79
RUBRIBULOSE-1,5-DIPHOSPHATEA,B9RUB0.76
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1RCX0.76
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,L1RXO0.76
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.84
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.84
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.82
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.82
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.82
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.82
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.82
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.82
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.82
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B1FQO0.71
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B2GC20.71
HMS5-O-phosphono-L-ribuloseA,B1XBX0.78
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H0.84
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT0.84
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX0.84
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL0.84
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO0.84
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M0.84
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.72
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.78
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.78
5RPRIBULOSE-5-PHOSPHATEA1UJ50.78
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.78
5RPRIBULOSE-5-PHOSPHATEA2RIU0.78
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.78
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.78
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.78
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.78
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.78
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.78
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.78
P6T1,6-di-O-phosphono-D-tagatoseA,B3GAY0.82
FUDD-fructoseA,B,C,D2QUN0.71
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B2NXG0.72
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B,C,D,E,F,
G,H,I,J,K,L		2NX30.72
RNSL-RHAMNOSEA,B,C,D1X8D0.79
RNSL-RHAMNOSEA,B,C,D1DE60.79
RNSL-RHAMNOSEA,B,C,D2I560.79
TAGD-tagatoseA,B,C,D2QUM0.71
I22D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATEB2I220.84
KDP2-KETO-DEOXY-GALACTOSEA2V820.83