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Ligand · W97

W97 · 6-ethynyl-1-(pentan-3-yl)-1H-imidazo[4,5-b]pyrazin-2-ol

W97, 6-ethynyl-1-(pentan-3-yl)-1H-imidazo[4,5-b]pyrazin-2-ol (C12 H14 N4 O, 230.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
W97
Formula
C12 H14 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

W97 in 2 structures; the first of them:

  • 7KAA · NMR solution structures of tirasemtiv drug bound to a fast skeletal troponin C-troponin I… · W97 A202 · binds LEU43, VAL46, MET47, GLN52, GLU58, ILE62, MET82, MET83 and 5 more
  • 7KAA · NMR solution structures of tirasemtiv drug bound to a fast skeletal troponin C-troponin I… · W97 A202 · binds LEU43, VAL46, GLN52, GLU58, ILE62, MET82, MET83, GLN86 and 3 more

Residues it binds most

MET 2, GLN 2, LEU 2, ARG 2, GLU 2, ILE 2, VAL 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion

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