GL1X · GenesisL1 explorer

Ligand · 9X2

9X2 · ~{N}-(2,3-dihydro-1~{H}-inden-2-yl)-3-[[4-[[[(2~{S})-pyrrolidin-2-yl]carbonylamino]methyl]piperidin-1-yl]carbonylamino]pyrazine-2-carboxamide

9X2, ~{N}-(2,3-dihydro-1~{H}-inden-2-yl)-3-[[4-[[[(2~{S})-pyrrolidin-2-yl]carbonylamino]methyl]piperidin-1-yl]carbonylamino]pyrazine-2-carboxamide (C26 H33 N7 O3, 491.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
9X2
Formula
C26 H33 N7 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

9X2 in 2 structures; the first of them:

  • 7QB7 · Crystal Structure of Prolyl-tRNA synthetase (ProRS, Proline-tRNA ligase) from Plasmodium… · 9X2 A815 · binds ARG390, GLU392, LYS394, GLN395, PRO396, PHE399, ILE400, ARG401 and 15 more
  • 7QB7 · Crystal structure of prolyl-tRNA synthetase (prors, proline-tRNA ligase) from plasmodium… · 9X2 A815 · binds ARG390, GLU392, LYS394, GLN395, PRO396, PHE399, ILE400, ARG401 and 10 more

Residues it binds most

ARG 2, THR 2, PHE 2, GLN 2, GLU 2, LYS 2, PRO 2, ILE 2, GLY 1, HIS 1 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol
  • PRO · Proline

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