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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206964

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B2NXG0.8
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		2NX30.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEL1RLC0.77
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		1IR20.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H		1RBL0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W		1UW90.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D4RUB0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G8RUC0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,D,E,H,K,
O,R,V		1UWA0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDH0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V630.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W		1UZD0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDI0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G,I,K,
M,O		1GK80.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V6A0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1UPP0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V690.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W		1UZH0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1BWV0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,E,S,W1WDD0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1UPM0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,S,T,
U,V		1IR10.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V670.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,L1RBO0.77
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V680.77
LGTL-GLUCARIC ACIDA,B,C,D3CB30.82
LGTL-GLUCARIC ACIDA,B,C2PP30.82
DEZ4-PHOSPHO-D-ERYTHRONATEA,B,C,D,E2BET0.75
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.73
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.73
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.73
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.73
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.73
GLOD-GLUCOSE IN LINEAR FORMA1AC00.73
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.73
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.77
KDP2-KETO-DEOXY-GALACTOSEA2V820.91
DG62-DEOXY-GLUCITOL-6-PHOSPHATEA,B1JKI0.71
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
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.79
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.79
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.79
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.81
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H0.83
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT0.83
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX0.83
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL0.83
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO0.83
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M0.83
XBPXYLULOSE-1,5-BISPHOSPHATEA,B,C,D,E,F,
G,H		1RSC0.73
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.74
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.74
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.85
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.85
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.85
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.85
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.85
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.85
P6F1,6-di-O-phosphono-D-fructoseA,B3GB60.81
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		M1E6X0.74
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A,B2E400.74
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A2VWG0.74
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A,B3EQO0.74
I22D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATEB2I220.83
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.74
RUBRIBULOSE-1,5-DIPHOSPHATEA,B9RUB0.73
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1RCX0.73
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,L1RXO0.73
PA55-PHOSPHOARABINONIC ACIDA1NUH0.84
PA55-PHOSPHOARABINONIC ACIDA1X820.84
PA55-PHOSPHOARABINONIC ACIDA,B1QXR0.84
PA55-PHOSPHOARABINONIC ACIDA,B1G980.84
PA55-PHOSPHOARABINONIC ACIDA,B1TZC0.84
PA55-PHOSPHOARABINONIC ACIDA1GZV0.84
PA55-PHOSPHOARABINONIC ACIDA1X7N0.84
PA55-PHOSPHOARABINONIC ACIDA1C7R0.84
DERD-4-PHOSPHOERYTHRONIC ACIDA,B,C,D1LK70.75
DERD-4-PHOSPHOERYTHRONIC ACIDA,B2CXO0.75
P6T1,6-di-O-phosphono-D-tagatoseA,B3GAY0.81
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.77
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.72
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.74
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.74
5RPRIBULOSE-5-PHOSPHATEA1UJ50.74
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.74
5RPRIBULOSE-5-PHOSPHATEA2RIU0.74
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.74
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.74
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.74
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.74
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.74
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.74
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.74
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.93
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.93
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.93
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.93
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.93
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.93
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.93
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.93
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.93
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.93
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.79
HMS5-O-phosphono-L-ribuloseA,B1XBX0.74
KD03-deoxy-8-O-phosphono-D-manno-oct-
2-ulosonic acid		A,B3E120.84
DO83-DEOXY-D-MANNO-2-OCTULOSONATE-
8-PHOSPHATE		A1X6U0.73
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.81
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.81
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.81
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.81
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.81
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.81
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.81
GCOGLUCONIC ACIDB,C,D1BGG0.81
GCOGLUCONIC ACIDA,B1XLF0.81
GKRD-GLUCARATEA3CXT0.82
GKRD-GLUCARATEA,B1JCT0.82
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		2DCN0.82
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.93
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.93
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B1FQO0.71
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B2GC20.71
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.73
LI52-HYDROXY-4,5-DIOXOHEPTYL HYDROGEN PHOSPHONATEA,B1YCD0.73
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.75
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.75
AOSD-ALLOSEA,B,C,D2I570.73
CS2D-MANNONIC ACIDA,B,C,D2QJM0.81
CS2D-MANNONIC ACIDA,B3DBN0.81
FUDD-fructoseA,B,C,D2QUN0.71
HHG(2R)-2-HYDROXY-3-(PHOSPHONOOXY)PROPYL HEXANOATEA1Y9T0.7
HHG(2R)-2-HYDROXY-3-(PHOSPHONOOXY)PROPYL HEXANOATEA,B3E3C0.7
TAGD-tagatoseA,B,C,D2QUM0.71
R105-O-phosphono-D-ribonic acidA,B,C,D,E2VVQ0.84
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.76
R525-O-phosphono-D-riboseA,B,C,D,E2VVP0.75
DNOD-mannoseA3BDK0.73