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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206724

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.75
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.75
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.73
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.78
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.78
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H0.81
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT0.81
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX0.81
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL0.81
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO0.81
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M0.81
DO83-DEOXY-D-MANNO-2-OCTULOSONATE-
8-PHOSPHATE		A1X6U0.79
DERD-4-PHOSPHOERYTHRONIC ACIDA,B,C,D1LK70.71
DERD-4-PHOSPHOERYTHRONIC ACIDA,B2CXO0.71
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.76
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEL1RLC0.73
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		1IR20.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H		1RBL0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W		1UW90.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D4RUB0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G8RUC0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,D,E,H,K,
O,R,V		1UWA0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDH0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V630.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W		1UZD0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDI0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G,I,K,
M,O		1GK80.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V6A0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1UPP0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V690.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W		1UZH0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1BWV0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,E,S,W1WDD0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1UPM0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,S,T,
U,V		1IR10.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V670.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,L1RBO0.73
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V680.73
BEMbeta-D-mannuronic acidA2ZAA0.75
BEMbeta-D-mannuronic acidA2ZAC0.75
BEMbeta-D-mannuronic acidA2ZAB0.75
BEMbeta-D-mannuronic acidA1Y3N0.75
BEMbeta-D-mannuronic acidA1Y3P0.75
BEMbeta-D-mannuronic acidA,B1J1N0.75
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
DG04-O-alpha-D-galactopyranuronosyl-
alpha-D-galactopyranuronic acid		A3DYB0.7
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		2DCN0.94
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.79
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.79
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.79
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.79
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.79
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.79
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.79
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B2NXG0.75
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		2NX30.75
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.73
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.73
5RPRIBULOSE-5-PHOSPHATEA1UJ50.73
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.73
5RPRIBULOSE-5-PHOSPHATEA2RIU0.73
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.73
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.73
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.73
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.73
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.73
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.73
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.73
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.75
CS2D-MANNONIC ACIDA,B,C,D2QJM0.76
CS2D-MANNONIC ACIDA,B3DBN0.76
DEZ4-PHOSPHO-D-ERYTHRONATEA,B,C,D,E2BET0.71
AD0DIGALACTURONIC ACIDA,B2UVF0.7
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.71