PDB ligand accession: 3BV
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: CNNZTHKANUECTE-JMNVNGPASA-N
SMILES: CC(C)CC(C(C(C)CO)O)NC(=O)C(Cc1ccccc1)NC(=O)C(CC(C)C)NC(=O)C(CCc2ccccc2)NC(=O)CN3CCOCC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 4QWJ | Download | Experimental | e4qwjH1 e4qwjI1 e4qwjV1 e4qwjW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5CZ8 | Download | Experimental | e5cz8H1 e5cz8I1 e5cz8V1 e5cz8W1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5D0Z | Download | Experimental | e5d0zH1 e5d0zI1 e5d0zZ1 e5d0zV1 e5d0zW1 e5d0zL1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5L65 | Download | Experimental | e5l65H1 e5l65I1 e5l65Z1 e5l65V1 e5l65W1 e5l65L1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QWL | Download | Experimental | e4qwlH1 e4qwlI1 e4qwlV1 e4qwlW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QW7 | Download | Experimental | e4qw7H1 e4qw7I1 e4qw7V1 e4qw7W1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QWS | Download | Experimental | e4qwsH1 e4qwsI1 e4qwsV1 e4qwsW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QW5 | Download | Experimental | e4qw5H1 e4qw5I1 e4qw5V1 e4qw5W1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QWI | Download | Experimental | e4qwiH1 e4qwiI1 e4qwiV1 e4qwiW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QW6 | Download | Experimental | e4qw6H1 e4qw6I1 e4qw6Z1 e4qw6V1 e4qw6W1 e4qw6L1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5CZ5 | Download | Experimental | e5cz5H1 e5cz5I1 e5cz5V1 e5cz5W1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QWF | Download | Experimental | e4qwfH1 e4qwfI1 e4qwfZ1 e4qwfV1 e4qwfW1 e4qwfL1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5D0V | Download | Experimental | e5d0vH1 e5d0vI1 e5d0vZ1 e5d0vV1 e5d0vW1 e5d0vL1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5FGE | Download | Experimental | e5fgeH1 e5fgeI1 e5fgeV1 e5fgeW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5FHS | Download | Experimental | e5fhsH1 e5fhsI1 e5fhsV1 e5fhsW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5L5E | Download | Experimental | e5l5eH1 e5l5eI1 e5l5eV1 e5l5eW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QW4 | Download | Experimental | e4qw4H1 e4qw4I1 e4qw4V1 e4qw4W1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5FGD | Download | Experimental | e5fgdH1 e5fgdI1 e5fgdV1 e5fgdW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5FGF | Download | Experimental | e5fgfH1 e5fgfI1 e5fgfV1 e5fgfW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QWK | Download | Experimental | e4qwkH1 e4qwkI1 e4qwkV1 e4qwkW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QWR | Download | Experimental | e4qwrH1 e4qwrI1 e4qwrV1 e4qwrW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5CZ9 | Download | Experimental | e5cz9H1 e5cz9I1 e5cz9V1 e5cz9W1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 4QWG | Download | Experimental | e4qwgH1 e4qwgI1 e4qwgV1 e4qwgW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5D0S | Download | Experimental | e5d0sH1 e5d0sI1 e5d0sV1 e5d0sW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5FGG | Download | Experimental | e5fggH1 e5fggI1 e5fggV1 e5fggW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
| 5L5Y | Download | Experimental | e5l5yH1 e5l5yI1 e5l5yV1 e5l5yW1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |