PDB ligand accession: HWS
DrugBank: DB01747
PubChem:
ChEMBL: n/a
InChI Key: FQIVLXIUJLOKPL-DWZMLRRXSA-N
SMILES: CC1=CC2=O[Fe]345(O=C(N(O3)CCCC6C(=O)NC(CCCN2O4)C(=O)N6)C=C(C)CCO)O=C(N(O5)CCCC(C(=O)OCC1)NC(=O)C)C=C(C)CCO
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 |
---|---|---|---|---|---|
6E4V | Download | Experimental | e6e4vA1 e6e4vA2 | Outer membrane meander beta-barrels N0 domain in phage tail proteins and secretins-like | LigPlot |