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Ligand · A1H97

A1H97 · (5~{R})-7-pyrazin-2-yl-2-oxa-7-azaspiro[4.4]nonane

A1H97, (5~{R})-7-pyrazin-2-yl-2-oxa-7-azaspiro[4.4]nonane (C11 H15 N3 O, 205.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
A1H97
Formula
C11 H15 N3 O
Class
ligand
Structures
2
PDB entries
2

Binding sites

A1H97 in 2 structures; the first of them:

  • 7HG2 · PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex… · A1H97 A104 · binds MET15, TYR18, TRP21, PHE44, THR47, GLU49
  • 9F4M · UP1 in complex with Z1401276297 · A1H97 A201 · binds PHE17, ARG55, PHE57, PHE59, LYS87, ARG88, ALA89, VAL90 and 1 more

Residues it binds most

PHE 2, ARG 1, ALA 1, GLU 1, HIS 1, LYS 1, MET 1, THR 1, TRP 1, TYR 1 (residue and the binding sites it lines).

Found with

  • U0S · (5S)-7-(pyrazin-2-yl)-2-oxa-7-azaspiro[4.4]nonane
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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