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Ligand · 1NX

1NX · 2-[[(3R)-3-acetamido-2,3-dihydro-1H-inden-5-yl]oxy]-N-[(1S)-1-cyclopropylethyl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

1NX, 2-[[(3R)-3-acetamido-2,3-dihydro-1H-inden-5-yl]oxy]-N-[(1S)-1-cyclopropylethyl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide (C23 H25 N5 O3, 419.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
1NX
Formula
C23 H25 N5 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

1NX in 2 structures; the first of them:

  • 3ZEP · Crystal Structure of JAK3 Kinase Domain in Complex with a Pyrrolopyrazine-2-phenyl Ether… · 1NX A2099 · binds GLN827, LEU828, GLY829, LYS830, GLY831, VAL836, ALA853, VAL884 and 13 more
  • 3ZEP · Crystal structure of JAK3 kinase domain in complex with a pyrrolopyrazine-2-phenyl ether… · 1NX A2099 · binds GLN827, LEU828, GLY829, LYS830, GLY831, VAL836, ALA853, VAL884 and 13 more

Residues it binds most

LEU 8, GLY 8, ALA 8, ARG 8, VAL 8, ASP 8, ASN 8, CYS 8, GLN 8, GLU 8 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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