PDB ligand accession: CHQ
DrugBank: DB02414
PubChem:
ChEMBL:
InChI Key: NAKUGCPAQTUSBE-IUCAKERBSA-N
SMILES: c1c([nH]cn1)CC2C(=O)N3CCCC3C(=O)N2
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 |
---|---|---|---|---|---|
1W1T | Download | Experimental | e1w1tA1 e1w1tA3 e1w1tB2 e1w1tA2 e1w1tB1 e1w1tB3 | FKBP-like TIM beta/alpha-barrel WW domain-like WW domain-like FKBP-like TIM beta/alpha-barrel | LigPlot |