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Ligand · K7R

K7R · 1-[(3~{S})-3-(2~{H}-pyrazolo[3,4-b]pyridin-3-yl)piperidin-1-yl]-2-thiophen-3-yl-ethanone

K7R, 1-[(3~{S})-3-(2~{H}-pyrazolo[3,4-b]pyridin-3-yl)piperidin-1-yl]-2-thiophen-3-yl-ethanone (C17 H18 N4 O S, 326.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component
K7R
Formula
C17 H18 N4 O S
Class
ligand
Structures
1
PDB entries
1

Binding sites

K7R in 1 structure; the first of them:

  • 8Q69 · Crystal structure of HsRNMT complexed with inhibitor DDD1060606 · K7R A502 · binds ARG173, ASN176, PHE285, TYR289, PHE360, LEU362, VAL365, VAL366 and 2 more

Residues it binds most

VAL 2, PHE 2, TYR 2, ARG 2, ASN 2, LEU 2 (residue and the binding sites it lines).

Found with

  • SAH · S-adenosyl-L-homocysteine
  • SO4 · Sulfate ion
  • GOL · Glycerol

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