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Ligand · 2HJ

2HJ · 4-({[(4-tert-butylphenyl)sulfonyl]amino}methyl)-N-(pyridin-3-yl)benzamide

2HJ, 4-({[(4-tert-butylphenyl)sulfonyl]amino}methyl)-N-(pyridin-3-yl)benzamide (C23 H25 N3 O3 S, 423.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
2HJ
Formula
C23 H25 N3 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

2HJ in 2 structures; the first of them:

  • 4N9D · Fragment-based Design of 3-Aminopyridine-derived Amides as Potent Inhibitors of Human… · 2HJ A601 · binds TYR188, HIS191, PHE193, ARG196, ASP219, TYR240, SER241, VAL242 and 11 more
  • 4N9D · Fragment-based design of 3-aminopyridine-derived amides as potent inhibitors of human… · 2HJ A601 · binds TYR188, HIS191, PHE193, ARG196, ASP219, TYR240, SER241, VAL242 and 11 more

Residues it binds most

ALA 4, TYR 4, ARG 4, ASP 4, ILE 4, SER 4, HIS 4, PHE 4, PRO 4, VAL 4 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion
  • EDO · 1,2-ethanediol

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