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Ligand · 4EW

4EW · 2-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-fluoro-N-[(1R,2S,3S,4R)-3-(1H-tetrazol-5-yl)bicyclo[2.2.2]oct-2-yl]pyrimidin-4-amine

4EW, 2-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-fluoro-N-[(1R,2S,3S,4R)-3-(1H-tetrazol-5-yl)bicyclo[2.2.2]oct-2-yl]pyrimidin-4-amine (C20 H19 Cl F N9, 439.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
4EW
Formula
C20 H19 Cl F N9
Class
ligand
Structures
2
PDB entries
1

Binding sites

4EW in 2 structures; the first of them:

  • 4YD0 · Influenza polymerase basic protein 2 (PB2) bound to an azaindole-tetrazole inhibitor · 4EW A201 · binds SER21, PHE23, SER24, PHE25, SER37, ARG55, HIS57, GLU61 and 7 more
  • 4YD0 · Influenza polymerase basic protein 2 (PB2) bound to an azaindole- tetrazole inhibitor · 4EW A201 · binds SER21, PHE23, SER24, PHE25, SER37, ARG55, HIS57, GLU61 and 7 more

Residues it binds most

PHE 2, SER 2, HIS 2, ARG 2, ASN 2, GLN 2, GLU 2, LYS 2, MET 2 (residue and the binding sites it lines).

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