GL1X · GenesisL1 explorer

Ligand · 3MS

3MS · N-{3-[4-hydroxy-1-(3-methylbutyl)-2-oxo-1,2-dihydropyrrolo[1,2-b]pyridazin-3-yl]-1,1-dioxido-2H-1,2,4-benzothiadiazin-7 -yl}methanesulfonamide

3MS, N-{3-[4-hydroxy-1-(3-methylbutyl)-2-oxo-1,2-dihydropyrrolo[1,2-b]pyridazin-3-yl]-1,1-dioxido-2H-1,2,4-benzothiadiazin-7 -yl}methanesulfonamide (C20 H23 N5 O6 S2, 493.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records…

Component
3MS
Formula
C20 H23 N5 O6 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

3MS in 2 structures; the first of them:

  • 3CO9 · Crystal structure of HCV NS5B polymerase with a novel pyridazi inhibitor · 3MS A579 · binds PHE193, PRO197, ARG200, THR287, SER288, ASN291, ASN316, GLY317 and 14 more
  • 3CO9 · Crystal structure of HCV NS5B polymerase with a novel pyridazinone inhibitor · 3MS A579 · binds PHE193, PRO197, ARG200, THR287, SER288, ASN291, ASN316, GLY317 and 14 more

Residues it binds most

ASN 4, GLY 4, SER 4, ASP 4, TYR 4, ARG 4, CYS 4, GLN 4, ILE 4, LEU 4 (residue and the binding sites it lines).

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.