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Ligand · KU0

KU0 · 2-[(2S)-1-(3,5-dichloropyridine-4-carbonyl)pyrrolidin-2-yl]-5-hydroxy-6-oxo-N-[2-(phenylsulfonyl)ethyl]-1,6-dihydropyrimidine-4-carboxamide

KU0, 2-[(2S)-1-(3,5-dichloropyridine-4-carbonyl)pyrrolidin-2-yl]-5-hydroxy-6-oxo-N-[2-(phenylsulfonyl)ethyl]-1,6-dihydropyrimidine-4-carboxamide (C23 H21 Cl2 N5 O6 S, 566.4 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records…

Component
KU0
Formula
C23 H21 Cl2 N5 O6 S
Class
ligand
Structures
3
PDB entries
2

Binding sites

KU0 in 3 structures; the first of them:

  • 5W92 · Crystal structure of the influenza virus PA endonuclease in complex with an inhibitor… · KU0 A203 · binds TYR24, LYS34, ALA37, ILE38, HIS41, GLU80, PHE105, LEU106 and 6 more
  • 5W92 · Crystal structure of the influenza virus pa endonuclease in complex with an inhibitor… · KU0 A203 · binds TYR24, LYS34, ILE38, HIS41, GLU80, PHE105, LEU106, ASP108 and 4 more
  • 5WFZ · Crystal structure of the influenza virus pa endonuclease (E119D mutant) in complex with… · KU0 A205 · binds TYR24, LYS34, ILE38, HIS41, GLU80, PHE105, LEU106, ASP108 and 5 more

Residues it binds most

LYS 3, ILE 3, GLU 3, TYR 3, ASP 3, HIS 3, LEU 3, PHE 3, ALA 1 (residue and the binding sites it lines).

Found with

  • MN · Manganese (II) ion
  • 9HD · 1-[(3R,5S,7R)-1,5,7,9-tetrakis(2-oxopyrrolidin-1-yl) nonan-3-yl]-1,3-dihydro-2H-pyrrol-2-one
  • SO4 · Sulfate ion
  • GOL · Glycerol

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