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Ligand · KEE

KEE · (1R,2R,3R)-2-[4-(1,3-oxazol-5-yl)phenyl]-N-oxidanyl-3-phenyl-cyclopropane-1-carboxamide

KEE, (1R,2R,3R)-2-[4-(1,3-oxazol-5-yl)phenyl]-N-oxidanyl-3-phenyl-cyclopropane-1-carboxamide (C19 H16 N2 O3, 320.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
KEE
Formula
C19 H16 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

KEE in 2 structures; the first of them:

  • 4CBY · Design, synthesis, and biological evaluation of potent and selective Class IIa HDAC… · KEE A2033 · binds PRO676, GLU677, ARG681, PRO800, HIS802, HIS803, GLY811, PHE812 and 9 more
  • 4CBY · Design, synthesis, and biological evaluation of potent and selective class iia hdac… · KEE A2033 · binds PRO676, GLU677, ARG681, PRO800, HIS802, HIS803, GLY811, PHE812 and 9 more

Residues it binds most

HIS 8, GLY 8, ASP 8, PRO 8, PHE 8, GLU 8, ARG 8, LEU 6 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • ZN · Zinc ion

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