Attributes
UniProt ID
Protein Name
Nitric oxide synthase 1
Ligand Name
6,6'-(pyridine-3,5-diyldiethane-2,1-diyl)bis(4-methylpyridin-2-amine)
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
KZHFSPGMRFCRCE-UHFFFAOYSA-N
SMILES
Cc1cc(nc(c1)N)CCc2cc(cnc2)CCc3cc(cc(n3)N)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3N5W
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Color Legend
Unassigned regionsLigand / hetero atomse3n5wA1e3n5wB1
ECOD domains from experimental PDB structures interacting with ligand XFJ
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P29476 | n/a | XFJ | 3n5w | e3n5wA1 | A:299-716 |
| P29476 | n/a | XFJ | 3n5w | e3n5wB1 | B:299-718 |
| P29476 | n/a | XFJ | 3n61 | e3n61A1 | A:299-716 |
| P29476 | n/a | XFJ | 3n61 | e3n61B1 | B:299-718 |
| P29476 | n/a | XFJ | 3n62 | e3n62A1 | A:299-716 |
| P29476 | n/a | XFJ | 3n62 | e3n62B1 | B:299-718 |
| P29476 | n/a | XFJ | 3n65 | e3n65A1 | A:299-716 |
| P29476 | n/a | XFJ | 3n65 | e3n65B1 | B:299-718 |
| P29476 | n/a | XFJ | 3n69 | e3n69A1 | A:67-482 |
| P29476 | n/a | XFJ | 3n69 | e3n69B1 | B:69-482 |
| P29476 | n/a | XFJ | 3n6b | e3n6bA1 | A:67-482 |
| P29476 | n/a | XFJ | 3n6b | e3n6bB1 | B:69-482 |
| P29476 | n/a | XFJ | 3n6f | e3n6fA1 | A:67-482 |
| P29476 | n/a | XFJ | 3n6f | e3n6fB1 | B:69-482 |