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Ligand · VVP

VVP · 4-methoxy-1H-indole

VVP, 4-methoxy-1H-indole (C9 H9 N O, 147.2 g/mol), in the MolNFT structures on GenesisL1: bound in 5 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
VVP
Formula
C9 H9 N O
Class
ligand
Structures
5
PDB entries
4

Binding sites

VVP in 5 structures; the first of them:

  • 5RLE · PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 helicase in complex… · VVP B701 · binds GLU551, THR552, ALA553, CYS556
  • 5SOE · PanDDA analysis group deposition -- Crystal Structure of Pseudomonas Aeruginosa… · VVP B501 · binds MET173, ARG176, ASN177, TYR180, GLU182, MET173, ARG176, ASN177 and 2 more
  • 7FSQ · SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with… · VVP A401 · binds ASP172, LYS176, CYS118, ASP120, ASN144, SER145, PRO146, LEU149
  • 9BBH · Co-crystal structure of human DDB1 bound to fragment UB028670 · VVP A1203 · binds THR13, VAL15, ILE33, LYS35, GLU40, TYR42, LEU49, PHE323 and 3 more
  • 5RLE · Pandda analysis group deposition -- crystal structure of SARS-cov-2 helicase in complex… · VVP B701 · binds GLU551, THR552, ALA553, CYS556

Residues it binds most

GLU 6, LEU 4, ARG 2, ASN 3, CYS 4, LYS 3, THR 3, ALA 3, ASP 2, ILE 3 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion
  • ZN · Zinc ion
  • EDO · 1,2-ethanediol
  • SO4 · Sulfate ion
  • UNX · Unknown atom or ion
  • DMS · Dimethyl sulfoxide
  • TLA · L(+)-tartaric acid

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