PDB ligand accession: TA1
DrugBank: DB01229
PubChem:
ChEMBL:
InChI Key: RCINICONZNJXQF-MZXODVADSA-N
SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(c5ccccc5)NC(=O)c6ccccc6)O)O)OC(=O)c7ccccc7)(CO4)OC(=O)C)O)C)OC(=O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Prenol lipids
- Subclass: Diterpenoids
- Class: Prenol lipids
- Superclass: Lipids and lipid-like molecules
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 4UXO | Download | Experimental | e4uxoB1 e4uxoB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 4AQV | Download | Experimental | e4aqvB1 e4aqvB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 2P4N | Download | Experimental | e2p4nB1 e2p4nB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5HNY | Download | Experimental | e5hnyB1 e5hnyB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 4UXY | Download | Experimental | e4uxyB1 e4uxyB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 5M5C | Download | Experimental | e5m5cE1 e5m5cE2 e5m5cB1 e5m5cB2 | Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5M5O | Download | Experimental | e5m5oB1 e5m5oB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 4UXS | Download | Experimental | e4uxsB1 e4uxsB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 5M5L | Download | Experimental | e5m5lB1 e5m5lB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 4CK7 | Download | Experimental | e4ck7B1 e4ck7B2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5HNX | Download | Experimental | e5hnxB1 e5hnxB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 4CK6 | Download | Experimental | e4ck6B1 e4ck6B2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5HNZ | Download | Experimental | e5hnzB1 e5hnzB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 3IZ0 | Download | Experimental | e3iz0B1 e3iz0B2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 3DCO | Download | Experimental | e3dcoB1 e3dcoB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5ND3 | Download | Experimental | e5nd3B1 e5nd3B2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 4AQW | Download | Experimental | e4aqwB1 e4aqwB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5M5N | Download | Experimental | e5m5nB1 e5m5nB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 5ND2 | Download | Experimental | e5nd2B1 e5nd2B2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5M5M | Download | Experimental | e5m5mB1 e5m5mB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 4CK5 | Download | Experimental | e4ck5B1 e4ck5B2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5HNW | Download | Experimental | e5hnwB1 e5hnwB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 5ND7 | Download | Experimental | e5nd7B1 e5nd7B2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 4UY0 | Download | Experimental | e4uy0B1 e4uy0B2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 4UXT | Download | Experimental | e4uxtB1 e4uxtB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 5M50 | Download | Experimental | e5m50E1 e5m50E2 e5m50B1 e5m50B2 | Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 1JFF | Download | Experimental | e1jffB1 e1jffB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 5M5I | Download | Experimental | e5m5iB1 e5m5iB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 5M54 | Download | Experimental | e5m54E1 e5m54E2 e5m54B1 e5m54B2 | Bacillus chorismate mutase-like Rossmann-like Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 5ND4 | Download | Experimental | e5nd4B1 e5nd4B2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |
| 4UXR | Download | Experimental | e4uxrB1 e4uxrB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |
| 4UXP | Download | Experimental | e4uxpB1 e4uxpB2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |