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Ligand · 4IO

4IO · 5-chloropyridin-3-yl 1-(3-nitrobenzene-1-sulfonyl)-1H-indole-5-carboxylate

4IO, 5-chloropyridin-3-yl 1-(3-nitrobenzene-1-sulfonyl)-1H-indole-5-carboxylate (C20 H12 Cl N3 O6 S, 457.8 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
4IO
Formula
C20 H12 Cl N3 O6 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

4IO in 1 structure; the first of them:

  • 7RC1 · X-ray structure of SARS-cov main protease covalently modified by compound grl-0686 · 4IO A401 · binds LEU27, PRO39, HIS41, MET49, CYS145, HIS164, MET165, GLU166 and 6 more

Residues it binds most

GLN 1, HIS 1, LEU 1, MET 1, ARG 1, ASP 1, CYS 1, GLU 1, PRO 1, THR 1 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide

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