PDB ligand accession: 1CP
DrugBank: DB03727
PubChem:
ChEMBL: n/a
InChI Key: WIUGGJKHYQIGNH-UHFFFAOYSA-N
SMILES: Cc1c2[nH]c(c1CCC(=O)O)Cc3c(c(c([nH]3)Cc4c(c(c([nH]4)Cc5c(c(c([nH]5)C2)CCC(=O)O)C)CCC(=O)O)C)CCC(=O)O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Tetrapyrroles and derivatives
- Subclass: Porphyrins
- Class: Tetrapyrroles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1R3S | Download | Experimental | e1r3sA1 | TIM beta/alpha-barrel | LigPlot |
1R3V | Download | Experimental | e1r3vA1 | TIM beta/alpha-barrel | LigPlot |
1R3Q | Download | Experimental | e1r3qA1 | TIM beta/alpha-barrel | LigPlot |