Ligand · S85
S85 · N1-(3-(2-(6-amino-4-methylpyridin-2-yl)ethyl)-5-fluorophenyl)-N1,N2-dimethylethane-1,2-diamine
S85, N1-(3-(2-(6-amino-4-methylpyridin-2-yl)ethyl)-5-fluorophenyl)-N1,N2-dimethylethane-1,2-diamine (C18 H25 F N4, 316.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its…
- Component
- S85
- Formula
- C18 H25 F N4
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
S85 in 4 structures; the first of them:
- 4UH3 · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · S85 A800 · binds MET336, GLN478, PRO565, VAL567, ASN569, MET570, PHE584, SER585 and 7 more
- 4UH9 · Structure of bovine endothelial nitric oxide synthase heme domain in complex with… · S85 A800 · binds VAL106, GLN249, PRO336, VAL338, ASN340, MET341, PHE355, SER356 and 7 more
- 4UH3 · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · S85 A800 · binds MET336, GLN478, PRO565, VAL567, ASN569, MET570, PHE584, SER585 and 7 more
- 4UH9 · Structure of bovine endothelial nitric oxide synthase heme domain in complex with… · S85 A800 · binds VAL106, GLN249, PRO336, VAL338, ASN340, MET341, PHE355, SER356 and 7 more
Residues it binds most
MET 8, TRP 8, TYR 8, GLU 10, VAL 8, ASN 8, GLN 8, GLY 8, PHE 8, PRO 8 (residue and the binding sites it lines).
Found with
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