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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02443859

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
E7BA,B3E7B0.7
RGCREIDISPONGIOLIDE CA2ASP0.75
13T13-DEOXYTEDANOLIDE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z
2OTJ0.81
OKAOKADAIC ACIDA1JK70.72
OKAOKADAIC ACIDC2IE40.72
OKAOKADAIC ACIDA1U320.72
FUGFUMAGILLINA,B3FMQ0.71
FUGFUMAGILLINA1BOA0.71
SC1[3R-[3A,4A,5B(S*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID
A1X8R0.72
WINmethyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)-
15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}-
3,11,12-trihydroxy-2,16-dioxo-13,20-
epoxypicras-3-en-21-oate
0,1,2,3,9,A,
B,C,F,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z
3G710.75
PXTPECTENOTOXIN-2A2Q0U0.7
PXTPECTENOTOXIN-2A2Q0R0.7
RC1[3R-[3A,4A,5B(R*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID
A2PQC0.72
RC1[3R-[3A,4A,5B(R*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID
A1X8T0.72
OVA3,4-DIHYDROXY-2-METHOXY-4-METHYL-
3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) -
OXIRANYL]-CYCLOHEXANONE
A2GZ50.75
OVA3,4-DIHYDROXY-2-METHOXY-4-METHYL-
3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) -
OXIRANYL]-CYCLOHEXANONE
A1B590.75
SRNSORANGICIN AC,D1YNJ0.72
MRCMUPIROCINA1JZS0.77
MRCMUPIROCINA,T1FFY0.77
MRCMUPIROCINA1QU30.77
MRCMUPIROCINA,T1QU20.77
PULA2C780.73
TG1A,B2AGV0.82
TG1A2ZBF0.82
TG1A2ZBG0.82
TG1A,B,C,D1WPG0.82
TG1A2C8L0.82
TG1A2EAR0.82
TG1A,B1IWO0.82
TG1A2C880.82
TG1A2DQS0.82
TG1A2C8K0.82
TG1A1XP50.82
TG1A2EAT0.82
EPS5-[(1-CARBOXYVINYL)OXY]-4-HYDROXY-
3-(PHOSPHONOOXY)CYCLOHEX-1-ENE-
1-CARBOXYLIC ACID
A2O0Z0.71
EPS5-[(1-CARBOXYVINYL)OXY]-4-HYDROXY-
3-(PHOSPHONOOXY)CYCLOHEX-1-ENE-
1-CARBOXYLIC ACID
A,B,C,D1QXO0.71
PRB13-ACETYLPHORBOLA1PTR0.77
SKP5-(1-CARBOXY-1-PHOSPHONOOXY-ETHOXYL)-
4-HYDROXY-3-PHOSPHONOOXY-CYCLOHEX-
1-ENECARBOXYLIC ACID
A2O0X0.71
SKP5-(1-CARBOXY-1-PHOSPHONOOXY-ETHOXYL)-
4-HYDROXY-3-PHOSPHONOOXY-CYCLOHEX-
1-ENECARBOXYLIC ACID
A1Q360.71
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one
A3B2S0.75