PDB ligand accession: PL2
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: SIKJBFNFPRPKQR-UHFFFAOYSA-N
SMILES: [H]N=C(N)NCCCCNCc1c(cnc(c1O)C)COP(=O)(O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridoxamines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2NVA | Download | Experimental | e2nvaA1 e2nvaA2 e2nvaB1 e2nvaA1 e2nvaA2 e2nvaB1 e2nvaB2 e2nvaC1 e2nvaC2 e2nvaD1 e2nvaC1 e2nvaD1 e2nvaD2 e2nvaE1 e2nvaE2 e2nvaF1 e2nvaE1 e2nvaE2 e2nvaF1 e2nvaF2 e2nvaG1 e2nvaG2 e2nvaH1 e2nvaG1 e2nvaG2 e2nvaH1 e2nvaH2 | 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 TIM beta/alpha-barrel cradle loop 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 TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel | LigPlot |