Ligand · 88J

88J · (S)-[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl](1-methyl-1H-imidazol-5-yl)(pyridin-4-yl)methanol

88J, (S)-[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl](1-methyl-1H-imidazol-5-yl)(pyridin-4-yl)methanol (C27 H24 Cl N5 O, 470.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component: 88J
Formula: C27 H24 Cl N5 O
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

88J in 2 structures; the first of them:

5UFR · Structure of RORgt bound to · 88J A601 · binds GLN286, LEU287, CYS320, HIS323, LEU324, MET365, VAL376, PHE377 and 7 more
5UFR · Structure of rorgt bound to · 88J A601 · binds GLN286, LEU287, CYS320, HIS323, LEU324, MET365, VAL376, PHE377 and 7 more

Residues it binds most

PHE 4, LEU 4, ILE 4, CYS 4, GLN 4, GLU 4, HIS 4, MET 4, VAL 2 (residue and the binding sites it lines).

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