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Ligand · 04R

04R · [3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetic acid

04R, [3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetic acid (C10 H11 F3 N2 O2, 248.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
04R
Formula
C10 H11 F3 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

04R in 2 structures; the first of them:

  • 5RUP · PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in… · 04R A201 · binds ALA129, GLY130, ALA134, PRO136, ALA154, VAL155, PHE156, ASP157 and 1 more
  • 5RUP · Pandda analysis group deposition -- crystal structure of SARS-cov-2 NSP3 macrodomain in… · 04R A201 · binds ALA129, GLY130, ALA134, PRO136, ALA154, VAL155, PHE156, ASP157 and 1 more

Residues it binds most

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

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