Ligand · IU1

IU1 · 1-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-(pyrrolidin-1-yl)ethan-1-one

IU1, 1-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-(pyrrolidin-1-yl)ethan-1-one (C18 H21 F N2 O, 300.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component: IU1
Formula: C18 H21 F N2 O
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

IU1 in 2 structures; the first of them:

6IIK · USP14 catalytic domain with IU1 · IU1 A501 · binds GLU188, LEU196, GLN197, GLN198, ASP199, PHE331, LYS342, HIS426 and 5 more
6IIK · USP14 catalytic domain with IU1 · IU1 A501 · binds GLU188, GLN197, GLN198, ASP199, PHE331, LYS342, HIS426, SER431 and 4 more

Residues it binds most

SER 4, GLN 4, TYR 4, ASP 4, HIS 4, LYS 4, GLU 3, LEU 2, PHE 2 (residue and the binding sites it lines).

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