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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03079425

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
PA55-PHOSPHOARABINONIC ACIDA1NUH0.78
PA55-PHOSPHOARABINONIC ACIDA1X820.78
PA55-PHOSPHOARABINONIC ACIDA,B1QXR0.78
PA55-PHOSPHOARABINONIC ACIDA,B1G980.78
PA55-PHOSPHOARABINONIC ACIDA,B1TZC0.78
PA55-PHOSPHOARABINONIC ACIDA1GZV0.78
PA55-PHOSPHOARABINONIC ACIDA1X7N0.78
PA55-PHOSPHOARABINONIC ACIDA1C7R0.78
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.91
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.91
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.91
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.91
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.91
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.91
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.91
AOSD-ALLOSEA,B,C,D2I570.76
CS2D-MANNONIC ACIDA,B,C,D2QJM0.75
CS2D-MANNONIC ACIDA,B3DBN0.75
LI52-HYDROXY-4,5-DIOXOHEPTYL HYDROGEN PHOSPHONATEA,B1YCD0.79
DNOD-mannoseA3BDK0.76
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.87
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.87
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.72
P6T1,6-di-O-phosphono-D-tagatoseA,B3GAY0.91
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
HMS5-O-phosphono-L-ribuloseA,B1XBX0.81
KD03-deoxy-8-O-phosphono-D-manno-oct-
2-ulosonic acid		A,B3E120.87
TAGD-tagatoseA,B,C,D2QUM0.77
RNSL-RHAMNOSEA,B,C,D1X8D0.7
RNSL-RHAMNOSEA,B,C,D1DE60.7
RNSL-RHAMNOSEA,B,C,D2I560.7
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.72
FUDD-fructoseA,B,C,D2QUN0.77
F2P1,6-DI-O-PHOSPHONO-D-ALLITOLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T		2QJG0.72
F2P1,6-DI-O-PHOSPHONO-D-ALLITOLA,B,C,D,E,F,
G,H,I,J		1W8R0.72
GCOGLUCONIC ACIDB,C,D1BGG0.75
GCOGLUCONIC ACIDA,B1XLF0.75
IBSL-ALPHA-GLYCEROPHOSPHO-D-MYO-INOSITOL-
4,5-BIS-PHOSPHATE		A1I7E0.75
DEZ4-PHOSPHO-D-ERYTHRONATEA,B,C,D,E2BET0.7
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.7
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEL1RLC0.75
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		1IR20.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H		1RBL0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W		1UW90.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D4RUB0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G8RUC0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,D,E,H,K,
O,R,V		1UWA0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDH0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V630.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W		1UZD0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDI0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G,I,K,
M,O		1GK80.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V6A0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1UPP0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V690.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W		1UZH0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1BWV0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,E,S,W1WDD0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1UPM0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,S,T,
U,V		1IR10.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V670.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,L1RBO0.75
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V680.75
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.87
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.87
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.87
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.87
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.87
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.87
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.87
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.87
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.87
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.87
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.74
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.81
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.81
5RPRIBULOSE-5-PHOSPHATEA1UJ50.81
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.81
5RPRIBULOSE-5-PHOSPHATEA2RIU0.81
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.81
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.81
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.81
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.81
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.81
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.81
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.81
KDP2-KETO-DEOXY-GALACTOSEA2V820.88
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.71
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.72
M2PD-MANNITOL-1,6-DIPHOSPHATEA2Q8J0.72
M2PD-MANNITOL-1,6-DIPHOSPHATEA,B,C,D2QDH0.72
M2PD-MANNITOL-1,6-DIPHOSPHATEA,B,C,D1ZAJ0.72
R105-O-phosphono-D-ribonic acidA,B,C,D,E2VVQ0.78
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.75
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.88
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.88
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.88
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.88
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.88
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.88
DO83-DEOXY-D-MANNO-2-OCTULOSONATE-
8-PHOSPHATE		A1X6U0.73
R525-O-phosphono-D-riboseA,B,C,D,E2VVP0.78
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.78
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		2DCN0.76
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.73
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.73
DERD-4-PHOSPHOERYTHRONIC ACIDA,B,C,D1LK70.7
DERD-4-PHOSPHOERYTHRONIC ACIDA,B2CXO0.7
RUBRIBULOSE-1,5-DIPHOSPHATEA,B9RUB0.82
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1RCX0.82
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,L1RXO0.82
LGTL-GLUCARIC ACIDA,B,C,D3CB30.77
LGTL-GLUCARIC ACIDA,B,C2PP30.77
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B2NXG0.86
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		2NX30.86
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.77
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.77
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.77
P6F1,6-di-O-phosphono-D-fructoseA,B3GB60.91
XBPXYLULOSE-1,5-BISPHOSPHATEA,B,C,D,E,F,
G,H		1RSC0.82
I22D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATEB2I220.96
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.76
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.76
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.76
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.76
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.76
GLOD-GLUCOSE IN LINEAR FORMA1AC00.76
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.76
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H0.89
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT0.89
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX0.89
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL0.89
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO0.89
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M0.89