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Ligand · I4X

I4X · 6-propan-2-yl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole

I4X, 6-propan-2-yl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole (C11 H11 N3 S, 217.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
I4X
Formula
C11 H11 N3 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

I4X in 1 structure; the first of them:

  • 7R5D · PARP15 catalytic domain in complex with OUL234 · I4X A701 · binds PHE558, HIS559, GLY560, ALA583, SER585, TYR586, TYR591, ALA593 and 4 more

Residues it binds most

TYR 1, ALA 1, SER 1, GLY 1, HIS 1, LEU 1, PHE 1 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide

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