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Ligand · WTD

WTD · 2-(2,6-difluorophenyl)-5-hydroxy-N-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-6-oxo-3,6-dihydropyrimidine-4-carboxamide

WTD, 2-(2,6-difluorophenyl)-5-hydroxy-N-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-6-oxo-3,6-dihydropyrimidine-4-carboxamide (C20 H17 F2 N3 O5, 417.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every…

Component
WTD
Formula
C20 H17 F2 N3 O5
Class
ligand
Structures
4
PDB entries
2

Binding sites

WTD in 4 structures; the first of them:

  • 7KNR · The crystal structure of the I38T mutant PA endonuclease (2009/H1N1/California) in… · WTD A203 · binds ALA20, MET21, TYR24, GLU26, LYS34, ALA37, THR38, HIS41 and 8 more
  • 7MX0 · The crystal structure of wild type PA endonuclease (2009/H1N1/CALIFORNIA) in complex with… · WTD A203 · binds ALA20, MET21, TYR24, GLU26, LYS34, ALA37, ILE38, HIS41 and 7 more
  • 7KNR · The crystal structure of the I38T mutant pa endonuclease (2009/H1N1/CALIFORNIA) in… · WTD A203 · binds ALA20, TYR24, GLU26, LYS34, HIS41, GLU80, ASP108, GLU119 and 3 more
  • 7MX0 · The crystal structure of wild type pa endonuclease (2009/H1N1/CALIFORNIA) in complex with… · WTD A203 · binds ALA20, TYR24, GLU26, LYS34, ILE38, HIS41, GLU80, ASP108 and 3 more

Residues it binds most

GLU 4, TYR 4, ALA 4, ILE 4, LYS 4, ASP 4, HIS 4, GLY 2, LEU 2, MET 2 (residue and the binding sites it lines).

Found with

  • QQ4 · Hexa Vinylpyrrolidone K15
  • MN · Manganese (II) ion
  • SO4 · Sulfate ion

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