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Ligand · QPL

QPL · (1R,2R)-4-hydroxy-1-{[2-(hydroxymethyl)-1H-benzimidazole-5-carbonyl]amino}-2,3-dihydro-1H-indene-2-carboxylic acid

QPL, (1R,2R)-4-hydroxy-1-{[2-(hydroxymethyl)-1H-benzimidazole-5-carbonyl]amino}-2,3-dihydro-1H-indene-2-carboxylic acid (C19 H17 N3 O5, 367.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
QPL
Formula
C19 H17 N3 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

QPL in 2 structures; the first of them:

  • 5SQD · PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in… · QPL A201 · binds ASP22, ALA38, GLY48, VAL49, ALA52, PRO125, LEU126, LEU127 and 9 more
  • 5SQD · Pandda analysis group deposition -- crystal structure of SARS-cov-2 NSP3 macrodomain in… · QPL A201 · binds ASP22, ALA38, GLY48, VAL49, ALA52, LEU126, LEU127, SER128 and 6 more

Residues it binds most

ALA 2, GLY 2, LEU 2, PHE 2, ASP 2, VAL 2, ILE 2, SER 2, PRO 1 (residue and the binding sites it lines).

Found with

  • QPX · (1S,2S)-4-hydroxy-1-{[2-(hydroxymethyl)-1H-benzimidazole-5-carbonyl]amino}-2,3-dihydro-1H-indene-2-carboxylic acid

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