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Ligand · VGI

VGI · 2-(3-bromophenyl)-6-[(2-hydroxyethyl)amino]-1h-benzo[de]isoquinoline-1,3(2h)-dione

VGI, 2-(3-bromophenyl)-6-[(2-hydroxyethyl)amino]-1h-benzo[de]isoquinoline-1,3(2h)-dione (C20 H15 Br N2 O3, 411.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within…

Component
VGI
Formula
C20 H15 Br N2 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

VGI in 4 structures; the first of them:

  • 2WHO · Crystal structure of hepatitis C virus NS5B polymerase from 1B genotype in complex with a… · VGI A1534 · binds LEU419, ARG422, MET423, LEU474, HIS475, TYR477, ILE482, ALA486 and 4 more
  • 3HVO · Structure of the genotype 2B HCV polymerase bound to a NNI · VGI A564 · binds ILE419, ARG422, MET423, LEU474, HIS475, TYR477, LEU482, ALA486 and 4 more
  • 2WHO · Crystal structure of hepatitis C virus NS5B polymerase from 1B genotype in complex with a… · VGI A1534 · binds LEU419, ARG422, MET423, LEU474, HIS475, TYR477, ILE482, ALA486 and 4 more
  • 3HVO · Structure of the genotype 2B HCV polymerase bound to a nni · VGI A564 · binds ILE419, ARG422, MET423, LEU474, HIS475, TYR477, LEU482, ALA486 and 4 more

Residues it binds most

LEU 8, ARG 8, HIS 8, ILE 8, MET 8, TRP 8, TYR 8, ALA 6, LYS 4 (residue and the binding sites it lines).

Found with

  • MN · Manganese (II) ion

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