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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03261025

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MRCMUPIROCINA1JZS0.71
MRCMUPIROCINA,T1FFY0.71
MRCMUPIROCINA1QU30.71
MRCMUPIROCINA,T1QU20.71
UNG4-O-(4-DEOXY-BETA-L-THREO-HEX-4-
ENOPYRANURONOSYL)-ALPHA-D-GALACTOPYRANURONIC ACID		A2UVI0.71
SC1[3R-[3A,4A,5B(S*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID		A1X8R0.72
AB03,7:6,10:9,14-TRIANHYDRO-2,5,11,12,13-
PENTADEOXY-4-O-(METHOXYMETHYL)-
L-ARABINO-L-ALLO-TETRADEC-12-ENONIC ACID		H,L2E270.71
UNF4-O-(4-deoxy-beta-L-threo-hex-4-
enopyranuronosyl)-beta-D-galactopyranuronic acid		A,B2VZQ0.71
UNF4-O-(4-deoxy-beta-L-threo-hex-4-
enopyranuronosyl)-beta-D-galactopyranuronic acid		A2W470.71
9OH(TRANS-12,13-EPOXY)-9-HYDROXY-10(E)-
OCTADECENOIC ACID		A1IK30.72
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
11O(TRANS-12,13-EPOXY)-11-HYDROXY-
9(Z)-OCTADECENOIC ACID		A1IK30.72
FA12,3 -ANHYDRO-QUINIC ACIDA1H0R0.72
FA12,3 -ANHYDRO-QUINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1GU10.72
FA12,3 -ANHYDRO-QUINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		2C570.72
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2IYR0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A3BAF0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A3DOO0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1U8A0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1ZUI0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2EV90.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B,C,D2HK90.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2D5C0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYQ0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2AA90.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1ZYU0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2GPT0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2G1K0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2AAY0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYX0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2DFN0.75
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYS0.75
5HE(5R,6E,8Z,11Z,14Z,17Z)-5-hydroxyicosa-
6,8,11,14,17-pentaenoic acid		A,B2VV20.74
DHK3-DEHYDROSHIKIMATEA1WE20.71
DHK3-DEHYDROSHIKIMATEA,B1SFJ0.71
DHK3-DEHYDROSHIKIMATEA,B,C,D,E,F,
G,H,I,J,K,L		1GTZ0.71
DHK3-DEHYDROSHIKIMATEA2O7Q0.71
DHK3-DEHYDROSHIKIMATEA2O7S0.71
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
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