PDB ligand accession: PLP
DrugBank: DB00114
PubChem:
ChEMBL:
InChI Key: NGVDGCNFYWLIFO-UHFFFAOYSA-N
SMILES: Cc1c(c(c(cn1)COP(=O)(O)O)C=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridine carboxaldehydes
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2TOD | Download | Experimental | e2todA3 e2todA4 e2todB4 e2todA3 e2todA4 e2todB3 e2todB4 e2todC3 e2todC4 e2todD4 e2todC4 e2todD3 e2todD4 | TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel | LigPlot |
1F3T | Download | Experimental | e1f3tB4 e1f3tA1 e1f3tA2 e1f3tB3 e1f3tB4 e1f3tA1 e1f3tA2 e1f3tC1 e1f3tD1 e1f3tC2 e1f3tC1 e1f3tD1 e1f3tD2 | cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel | LigPlot |
1QU4 | Download | Experimental | e1qu4A3 e1qu4A4 e1qu4B4 e1qu4A3 e1qu4A4 e1qu4B3 e1qu4B4 e1qu4D4 e1qu4C3 e1qu4C4 e1qu4D3 e1qu4D4 e1qu4C4 | TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel | LigPlot |