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Ligand · Q7L

Q7L · (3P)-3-(2H-1,3-benzodioxol-5-yl)-1H-pyrazole

Q7L, (3P)-3-(2H-1,3-benzodioxol-5-yl)-1H-pyrazole (C10 H8 N2 O2, 188.2 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
Q7L
Formula
C10 H8 N2 O2
Class
ligand
Structures
3
PDB entries
3

Binding sites

Q7L in 3 structures; the first of them:

  • 5SOB · PanDDA analysis group deposition -- Crystal Structure of Pseudomonas Aeruginosa… · Q7L A501 · binds ILE109, GLY110, GLY111, ILE115, PHE134, VAL135, SER138, ILE139 and 5 more
  • 7FT1 · SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with… · Q7L C301 · binds GLY207, HIS208, PHE211, ILE212, PHE213, ALA255, LEU258, SER259 and 2 more
  • 7H7L · Group deposition for crystallographic fragment screening of Chikungunya virus nsP3… · Q7L A209 · binds MET9, ASP10, ILE11, GLY32, VAL33, ALA36, TYR142, CYS143 and 1 more

Residues it binds most

ILE 6, ARG 6, ASP 6, GLY 5, TYR 5, CYS 5, MET 5, ALA 4, VAL 4, PHE 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide
  • ALA · Alanine
  • DGL · D-glutamic acid
  • GLY · Glycine
  • CL · Chloride ion
  • PO4 · Phosphate ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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