PDB ligand accession: ABU
DrugBank: DB02530
PubChem: 119;6992099;
ChEMBL:
InChI Key: BTCSSZJGUNDROE-UHFFFAOYSA-N
SMILES: C(CC(=O)O)CN
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 |
---|---|---|---|---|---|
6DW1 | Download | Experimental | e6dw1C1 e6dw1B1 e6dw1A1 e6dw1B1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
6DW0 | Download | Experimental | e6dw0E2 e6dw0A1 e6dw0A1 e6dw0B1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |