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Ligand · H6G

H6G · N-[6-(4-acryloyl-1,4-diazepan-1-yl)-2-(pyridin-2-yl) pyrimidin-4-yl]-beta-alanine

H6G, N-[6-(4-acryloyl-1,4-diazepan-1-yl)-2-(pyridin-2-yl) pyrimidin-4-yl]-beta-alanine (C20 H24 N6 O3, 396.4 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
H6G
Formula
C20 H24 N6 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

H6G in 2 structures; the first of them:

  • 6DQ5 · LINKED KDM5A JMJ DOMAIN BOUND TO THE INHIBITOR N43 i.e.… · H6G A601 · binds ARG73, GLN75, TYR409, ALA411, ASP412, TYR472, SER479, PHE480 and 10 more
  • 6DQ5 · Linked KDM5A jmj domain bound to the inhibitor N43 I.E. 3-((6-(4… · H6G A601 · binds ARG73, TYR409, ALA411, ASP412, TYR472, SER479, PHE480, CYS481 and 6 more

Residues it binds most

ALA 2, ASP 2, TYR 2, GLN 2, ARG 2, CYS 2, GLU 2, HIS 2, LYS 2, PHE 2 (residue and the binding sites it lines).

Found with

  • MN · Manganese (II) ion

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