Ligand · S71

S71 · (R)-6-(3-amino-2-(5-(2-(6-amino-4-methylpyridin-2-yl)ethyl)pyridin-3-yl)propyl)-4-methylpyridin-2-amine

S71, (R)-6-(3-amino-2-(5-(2-(6-amino-4-methylpyridin-2-yl)ethyl)pyridin-3-yl)propyl)-4-methylpyridin-2-amine (C22 H28 N6, 376.5 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its…

Component: S71
Formula: C22 H28 N6
Class: ligand
Structures: 6
PDB entries: 3

Binding sites

S71 in 6 structures; the first of them:

4CTW · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · S71 A1719 · binds MET336, LEU337, ARG414, GLN478, ARG481, PRO565, VAL567, PHE584 and 9 more
4CU0 · Structure of bovine endothelial nitric oxide synthase heme domain in complex with… · S71 A800 · binds VAL106, LEU107, ARG185, GLN249, PRO336, VAL338, PHE355, SER356 and 8 more
4CX7 · Structure of human iNOS heme domain in complex with (R)-6-(3-AMINO-2-(5-(2-(6-AMINO-4… · S71 A800 · binds MET120, THR121, ARG199, GLN263, ARG266, PRO350, VAL352, PHE369 and 9 more
4CTW · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · S71 A1719 · binds MET336, LEU337, ARG414, GLN478, ARG481, PRO565, VAL567, PHE584 and 9 more
4CU0 · Structure of bovine endothelial nitric oxide synthase heme domain in complex with… · S71 A800 · binds VAL106, LEU107, ARG185, GLN249, PRO336, VAL338, PHE355, SER356 and 8 more
4CX7 · Structure of human inos heme domain in complex with (R)-6-( 3-amino-2-(5-(2-(6-amino-4… · S71 A800 · binds MET120, THR121, ARG199, GLN263, ARG266, PRO350, VAL352, PHE369 and 9 more

Residues it binds most

TRP 16, TYR 16, MET 16, ARG 16, VAL 16, GLN 16, GLU 16, GLY 16, PHE 16, PRO 16 (residue and the binding sites it lines).

Found with

H4B · 5,6,7,8-tetrahydrobiopterin
HEM · Protoporphyrin IX containing Fe
ZN · Zinc ion
ACT · Acetate ion
GOL · Glycerol
SO4 · Sulfate ion

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