Ligand · YIY

YIY · (1E)-1-[5-tert-butyl-2-(3-fluorophenyl)-1H-pyrazol-3-ylidene]-3-(4-pyridin-3-yloxyphenyl)urea

YIY, (1E)-1-[5-tert-butyl-2-(3-fluorophenyl)-1H-pyrazol-3-ylidene]-3-(4-pyridin-3-yloxyphenyl)urea (C25 H24 F N5 O2, 445.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component: YIY
Formula: C25 H24 F N5 O2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

YIY in 2 structures; the first of them:

2YIY · Crystal structure of compound 8 bound to TAK1-TAB · YIY A4000 · binds VAL42, PHE47, VAL50, ALA61, LYS63, VAL76, GLU77, GLN80 and 15 more
2YIY · Crystal structure of compound 8 bound to TAK1-tab · YIY A4000 · binds VAL42, PHE47, VAL50, ALA61, LYS63, VAL76, GLU77, GLN80 and 15 more

Residues it binds most

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

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