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Ligand · 0E1

0E1 · (7R)-2-hydroxy-7-(propan-2-yl)-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile

0E1, (7R)-2-hydroxy-7-(propan-2-yl)-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile (C12 H14 N2 O2, 218.2 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5…

Component
0E1
Formula
C12 H14 N2 O2
Class
ligand
Structures
1
PDB entries
1

Binding sites

0E1 in 1 structure; the first of them:

  • 5C5R · Crystal structure of human tankyrase-2 in complex with a pyranopyridone inhibitor · 0E1 A1202 · binds PHE1030, HIS1031, GLY1032, SER1033, PRO1034, PHE1035, HIS1048, ALA1049 and 9 more

Residues it binds most

PHE 2, TYR 2, ALA 2, HIS 2, SER 2, GLY 2, ILE 2, LYS 2, PRO 2, GLU 1 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion

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