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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03078371

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DHK3-DEHYDROSHIKIMATEA1WE20.75
DHK3-DEHYDROSHIKIMATEA,B1SFJ0.75
DHK3-DEHYDROSHIKIMATEA,B,C,D,E,F,
G,H,I,J,K,L		1GTZ0.75
DHK3-DEHYDROSHIKIMATEA2O7Q0.75
DHK3-DEHYDROSHIKIMATEA2O7S0.75
DHS3-AMINO-4,5-DIHYDROXY-CYCLOHEX-
1-ENECARBOXYLATE		A,B,C,D1L9W0.75
DHS3-AMINO-4,5-DIHYDROXY-CYCLOHEX-
1-ENECARBOXYLATE		A,B1QFE0.75
SKP5-(1-CARBOXY-1-PHOSPHONOOXY-ETHOXYL)-
4-HYDROXY-3-PHOSPHONOOXY-CYCLOHEX-
1-ENECARBOXYLIC ACID		A2O0X0.75
SKP5-(1-CARBOXY-1-PHOSPHONOOXY-ETHOXYL)-
4-HYDROXY-3-PHOSPHONOOXY-CYCLOHEX-
1-ENECARBOXYLIC ACID		A1Q360.75
1642-(3-CARBOXYPROPIONYL)-6-HYDROXY-
CYCLOHEXA-2,4-DIENE CARBOXYLIC ACID		A1R6W0.73
FA12,3 -ANHYDRO-QUINIC ACIDA1H0R0.78
FA12,3 -ANHYDRO-QUINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1GU10.78
FA12,3 -ANHYDRO-QUINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		2C570.78
SPQ(3R,4S,5R)-5-{[(1R)-1-CARBOXY-2-
FLUORO-1-(PHOSPHONOOXY)ETHYL]OXY}-
4-HYDROXY-3-(PHOSPHONOOXY)CYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B,C,D1RF40.75
TSO(1R,3S,5S,8R)-8-HYDROXY-2-OXABICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B,C,D2W1A0.71
EPS5-[(1-CARBOXYVINYL)OXY]-4-HYDROXY-
3-(PHOSPHONOOXY)CYCLOHEX-1-ENE-
1-CARBOXYLIC ACID		A2O0Z0.78
EPS5-[(1-CARBOXYVINYL)OXY]-4-HYDROXY-
3-(PHOSPHONOOXY)CYCLOHEX-1-ENE-
1-CARBOXYLIC ACID		A,B,C,D1QXO0.78
GG9(3R,4S,5R)-5-[(1R)-1-CARBOXY-2,2-
DIFLUORO-1-(PHOSPHONOOXY)ETHOXY]-
4-HYDROXY-3-(PHOSPHONOOXY)CYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2PQB0.73
GG9(3R,4S,5R)-5-[(1R)-1-CARBOXY-2,2-
DIFLUORO-1-(PHOSPHONOOXY)ETHOXY]-
4-HYDROXY-3-(PHOSPHONOOXY)CYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2PQD0.73
GG9(3R,4S,5R)-5-[(1R)-1-CARBOXY-2,2-
DIFLUORO-1-(PHOSPHONOOXY)ETHOXY]-
4-HYDROXY-3-(PHOSPHONOOXY)CYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2PQ90.73
ATH4-HYDROXY-ACONITATE IONA1FGH0.72
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2IYR0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A3BAF0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A3DOO0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1U8A0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1ZUI0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2EV90.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B,C,D2HK90.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2D5C0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYQ0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2AA90.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1ZYU0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2GPT0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2G1K0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2AAY0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYX0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2DFN0.89
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYS0.89
RC1[3R-[3A,4A,5B(R*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID		A2PQC0.76
RC1[3R-[3A,4A,5B(R*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID		A1X8T0.76
S3PSHIKIMATE-3-PHOSPHATEA2O0D0.81
S3PSHIKIMATE-3-PHOSPHATEA2GGD0.81
S3PSHIKIMATE-3-PHOSPHATEA2IYY0.81
S3PSHIKIMATE-3-PHOSPHATEA2IYZ0.81
S3PSHIKIMATE-3-PHOSPHATEA2O0E0.81
S3PSHIKIMATE-3-PHOSPHATEA2QFQ0.81
S3PSHIKIMATE-3-PHOSPHATEA1G6T0.81
S3PSHIKIMATE-3-PHOSPHATEA1MI40.81
S3PSHIKIMATE-3-PHOSPHATEA3FK10.81
S3PSHIKIMATE-3-PHOSPHATEA2QFT0.81
S3PSHIKIMATE-3-PHOSPHATEA2QFU0.81
S3PSHIKIMATE-3-PHOSPHATEA2GG60.81
S3PSHIKIMATE-3-PHOSPHATEA2GGA0.81
S3PSHIKIMATE-3-PHOSPHATEA1G6S0.81
S3PSHIKIMATE-3-PHOSPHATEA3FK00.81
S3PSHIKIMATE-3-PHOSPHATEA3FJZ0.81
S3PSHIKIMATE-3-PHOSPHATEA2O0B0.81
S3PSHIKIMATE-3-PHOSPHATEA2QFS0.81
S3PSHIKIMATE-3-PHOSPHATEA,B,C,D1RF60.81
S3PSHIKIMATE-3-PHOSPHATEA3FJX0.81
FA32-ANHYDRO-3-FLUORO-QUINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1V1J0.77
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B1ECM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B,C,D,E,F,
G,H,I,J,K,L		2CHT0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		X2GTV0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		H1FIG0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B4CSM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B3CSM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		B2FP20.71
SC1[3R-[3A,4A,5B(S*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID		A1X8R0.76