PDB ligand accession: HEL
DrugBank: DB03820
PubChem: 5288535;131704259;
ChEMBL: n/a
InChI Key: LDJWRKFRKCXUDO-RBQWDTSBSA-M
SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)CCCCC(C(=O)[O-])NC(=O)C[NH3+])C(=O)[O-])C
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 |
---|---|---|---|---|---|
1PW1 | Download | Experimental | e1pw1A1 e1pw1A2 | alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like | LigPlot |