PDB ligand accession: ABY
DrugBank: DB02943
PubChem:
ChEMBL: n/a
InChI Key: OMOPDEZZBQHMGS-AWEZNQCLSA-N
SMILES: COc1ccc(cc1)CSCC(C(=O)NCC(=O)O)NC(=O)CCCN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Peptidomimetics
- Subclass: Hybrid peptides
- Class: Peptidomimetics
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1PL1 | Download | Experimental | e1pl1A2 e1pl1A1 e1pl1B1 e1pl1B2 e1pl1A1 e1pl1B1 | Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins | LigPlot |
1PL2 | Download | Experimental | e1pl2A2 e1pl2B1 e1pl2A1 e1pl2B2 e1pl2B1 e1pl2A1 | Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins | LigPlot |