Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02475454
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 |
CBU![]() | (1R,2R,3S,4S,5S,6S)-CYCLOHEXANE- 1,2,3,4,5,6-HEXOL | A,B | 2VT0 | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 3BXD | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1IEV | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1PTG | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B,C | 2OS9 | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B,C,D | 2R71 | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 1G0I | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 2HUO | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 1Y7V | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1AOD | 0.85 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 3EA2 | 0.85 | ![]() |
SOR![]() | D-SORBITOL | A | 1FQA | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A,B,C,D | 3XIM | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A | 2VFT | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A,B,C,D | 5XIM | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A | 3BRF | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A | 1XIH | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A | 2DXR | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A | 1D8C | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A,B,C,D | 2XIN | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A | 1FQB | 0.8 | ![]() |
SOR![]() | D-SORBITOL | A,B | 4XIA | 0.8 | ![]() |
MTL![]() | D-MANNITOL | A,B | 1ZZU | 0.8 | ![]() |
MTL![]() | D-MANNITOL | A,B | 1ZZQ | 0.8 | ![]() |
MTL![]() | D-MANNITOL | A,B | 1M2W | 0.8 | ![]() |
MTL![]() | D-MANNITOL | A | 2VFU | 0.8 | ![]() |
RNT![]() | L-RHAMNITOL | A,B,C,D | 1DE5 | 0.78 | ![]() |
FOC![]() | FUCITOL | A,B,C,D,E,F | 1FUI | 0.78 | ![]() |
ASO![]() | 1,5-ANHYDROSORBITOL | A | 1XIE | 0.75 | ![]() |
ASO![]() | 1,5-ANHYDROSORBITOL | A | 3GUH | 0.75 | ![]() |
ASO![]() | 1,5-ANHYDROSORBITOL | A,B | 2ASV | 0.75 | ![]() |
ASO![]() | 1,5-ANHYDROSORBITOL | H,L | 2EC9 | 0.75 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLC | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A | 1S5N | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A | 1W3Y | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A | 1NJR | 0.73 | ![]() |
XYL![]() | D-XYLITOL | G,H,L | 2B4C | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1FX5 | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLM | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B,C,D | 1XIN | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B,C,D | 2XIM | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A | 2VFS | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B,C,D | 1XIM | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A | 2XIS | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLG | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLD | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A | 1LTE | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLJ | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A | 1XIG | 0.73 | ![]() |
XYL![]() | D-XYLITOL | A,B | 5XIA | 0.73 | ![]() |
3HD![]() | 3-O-METHYL-O-ALPHA-D-MANNOPYRANOSYL | A | 2HGO | 0.73 | ![]() |
GLF![]() | 1-FLUORO-ALPHA-1-DEOXY-D-GLUCOSE | A | 1CXL | 0.72 | ![]() |
IPD![]() | D-MYO-INOSITOL-1-PHOSPHATE | A,B | 1IMA | 0.72 | ![]() |
IPD![]() | D-MYO-INOSITOL-1-PHOSPHATE | A,B | 1G0H | 0.72 | ![]() |
IPD![]() | D-MYO-INOSITOL-1-PHOSPHATE | A,B,C | 2ORK | 0.72 | ![]() |
IPD![]() | D-MYO-INOSITOL-1-PHOSPHATE | A,B | 1AWB | 0.72 | ![]() |
IPD![]() | D-MYO-INOSITOL-1-PHOSPHATE | A,B | 1LBX | 0.72 | ![]() |
LIP![]() | L-MYO-INOSITOL-1-PHOSPHATE | A,B | 1IMB | 0.72 | ![]() |
LIP![]() | L-MYO-INOSITOL-1-PHOSPHATE | A,B | 3C4V | 0.72 | ![]() |
YLL![]() | (1R,2S,3S,4S,5R,6R)-6-(HYDROXYMETHYL)CYCLOHEXANE- 1,2,3,4,5-PENTOL | A,B | 2JAL | 0.71 | ![]() |
I2P![]() | D-MYO-INOSITOL-2,4,5-TRIPHOSPHATE | A,B | 1DJY | 0.71 | ![]() |
2IP![]() | D-MYO-INOSITOL-1,4-BISPHOSPHATE | A | 1I9Z | 0.71 | ![]() |
IP2![]() | D-MYO-INOSITOL-4,5-BISPHOSPHATE | A | 1HG2 | 0.71 | ![]() |
IP2![]() | D-MYO-INOSITOL-4,5-BISPHOSPHATE | A,B | 1DJZ | 0.71 | ![]() |
I3S![]() | (1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO- INOSITOL | X | 1Z2P | 0.71 | ![]() |
I3S![]() | (1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO- INOSITOL | A | 2P0H | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 1H0A | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 1NU2 | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 1GC6 | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 1MAI | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 2P0D | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A,B | 1OQN | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 1U29 | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A,B | 1W2C | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A,B | 1DJX | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 2A98 | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 1N4K | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A,B | 3C5N | 0.71 | ![]() |
I3P![]() | D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE | A | 1BTN | 0.71 | ![]() |
ITP![]() | PHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY- 5-PHOSPHONOOXY-CYCLOHEXYL) ESTER | A,B | 1JOC | 0.71 | ![]() |
ITP![]() | PHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY- 5-PHOSPHONOOXY-CYCLOHEXYL) ESTER | A | 1HYI | 0.71 | ![]() |
BDF![]() | BETA-D-FRUCTOPYRANOSE | A | 1OVP | 0.7 | ![]() |
BDF![]() | BETA-D-FRUCTOPYRANOSE | A,B | 1N3Q | 0.7 | ![]() |
BDF![]() | BETA-D-FRUCTOPYRANOSE | B | 2FA1 | 0.7 | ![]() |
GUL![]() | 5-FLUORO-BETA-L-GULOSYL FLUORIDE | A | 1QWN | 0.7 | ![]() |
GUL![]() | 5-FLUORO-BETA-L-GULOSYL FLUORIDE | A | 1QWU | 0.7 | ![]() |