Attributes
UniProt ID
Protein Name
Nitric oxide synthase 3
Ligand Name
N-{(3R,4S)-4-[(6-amino-4-methylpyridin-2-yl)methyl]pyrrolidin-3-yl}-N'-(3-chlorobenzyl)ethane-1,2-diamine
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VWCMAGONQJHIJZ-LPHOPBHVSA-N
SMILES
Cc1cc(nc(c1)N)CC2CNCC2NCCNCc3cccc(c3)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: P29474_F1
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Color Legend
Unassigned regionsLigand / hetero atomsnD1nD2nD3nD4nD5
ECOD domains from AlphaFold model interacting with ligand DB08019
| UniProt | DrugBank | PDB Ligand | ECOD Domain | Range Definition |
|---|---|---|---|---|
| P29474 | DB08019 | JI7 | nD1 | 66-480 |
| P29474 | DB08019 | JI7 | nD2 | 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615, 641-725, 516-615,641-725 |
| P29474 | DB08019 | JI7 | nD3 | 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805, 936-995, 726-805,936-995 |
| P29474 | DB08019 | JI7 | nD4 | 806-935 |
| P29474 | DB08019 | JI7 | nD5 | 996-1185 |