Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03091417
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
FA3![]() | 2-ANHYDRO-3-FLUORO-QUINIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1V1J | 0.83 | ![]() |
TSA![]() | 8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON- 6-ENE-3,5-DICARBOXYLIC ACID | A,B | 1ECM | 0.74 | ![]() |
TSA![]() | 8-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 | 2CHT | 0.74 | ![]() |
TSA![]() | 8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON- 6-ENE-3,5-DICARBOXYLIC ACID | X | 2GTV | 0.74 | ![]() |
TSA![]() | 8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON- 6-ENE-3,5-DICARBOXYLIC ACID | H | 1FIG | 0.74 | ![]() |
TSA![]() | 8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON- 6-ENE-3,5-DICARBOXYLIC ACID | A,B | 4CSM | 0.74 | ![]() |
TSA![]() | 8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON- 6-ENE-3,5-DICARBOXYLIC ACID | A,B | 3CSM | 0.74 | ![]() |
TSA![]() | 8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON- 6-ENE-3,5-DICARBOXYLIC ACID | B | 2FP2 | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2O0D | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2GGD | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2IYY | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2IYZ | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2O0E | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2QFQ | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 1G6T | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 1MI4 | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 3FK1 | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2QFT | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2QFU | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2GG6 | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2GGA | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 1G6S | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 3FK0 | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 3FJZ | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2O0B | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 2QFS | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A,B,C,D | 1RF6 | 0.74 | ![]() |
S3P![]() | SHIKIMATE-3-PHOSPHATE | A | 3FJX | 0.74 | ![]() |
FA1![]() | 2,3 -ANHYDRO-QUINIC ACID | A | 1H0R | 0.86 | ![]() |
FA1![]() | 2,3 -ANHYDRO-QUINIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1GU1 | 0.86 | ![]() |
FA1![]() | 2,3 -ANHYDRO-QUINIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2C57 | 0.86 | ![]() |
4HD![]() | (4S,5E,7Z,10Z,13Z,16Z,19Z)-4-hydroxydocosa- 5,7,10,13,16,19-hexaenoic acid | A,B | 2VV1 | 0.71 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A,B | 2IYR | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 3BAF | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 3DOO | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 1U8A | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 1ZUI | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A,B | 2EV9 | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A,B,C,D | 2HK9 | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A,B | 2D5C | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2IYQ | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2AA9 | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 1ZYU | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2GPT | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2G1K | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2AAY | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2IYX | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2DFN | 0.81 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2IYS | 0.81 | ![]() |
LVA![]() | (3R,5R)-7-((1R,2R,6S,8R,8AS)-2,6- DIMETHYL-8-{[(2R)-2-METHYLBUTANOYL]OXY}- 1,2,6,7,8,8A-HEXAHYDRONAPHTHALEN- 1-YL)-3,5-DIHYDROXYHEPTANOIC ACID | A,B | 1T02 | 0.7 | ![]() |
114![]() | COMPACTIN | A,B,C,D | 1HW8 | 0.7 | ![]() |
164![]() | 2-(3-CARBOXYPROPIONYL)-6-HYDROXY- CYCLOHEXA-2,4-DIENE CARBOXYLIC ACID | A | 1R6W | 0.74 | ![]() |
5HE![]() | (5R,6E,8Z,11Z,14Z,17Z)-5-hydroxyicosa- 6,8,11,14,17-pentaenoic acid | A,B | 2VV2 | 0.79 | ![]() |
TSO![]() | (1R,3S,5S,8R)-8-HYDROXY-2-OXABICYCLO[3.3.1]NON- 6-ENE-3,5-DICARBOXYLIC ACID | A,B,C,D | 2W1A | 0.74 | ![]() |
T24![]() | (9Z,11E,13S,15Z)-13-hydroxyoctadeca- 9,11,15-trienoic acid | A,B | 3DSI | 0.71 | ![]() |
EAH![]() | (5S,7E,9E,11Z,14Z)-5-hydroxyicosa- 7,9,11,14-tetraenoic acid | A | 3DZT | 0.72 | ![]() |
PRE![]() | PREPHENIC ACID | A,B,C,D,E,F, G,H,K | 1COM | 0.74 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A | 1WE2 | 0.88 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A,B | 1SFJ | 0.88 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A,B,C,D,E,F, G,H,I,J,K,L | 1GTZ | 0.88 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A | 2O7Q | 0.88 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A | 2O7S | 0.88 | ![]() |