GL1X · GenesisL1 explorer

Ligand · 28M

28M · N-({(3S)-1-[6-tert-butyl-5-methoxy-8-(2-oxo-1,2-dihydropyridin-3-yl)quinolin-3-yl]pyrrolidin-3-yl}methyl)methanesulfonamide

28M, N-({(3S)-1-[6-tert-butyl-5-methoxy-8-(2-oxo-1,2-dihydropyridin-3-yl)quinolin-3-yl]pyrrolidin-3-yl}methyl)methanesulfonamide (C25 H32 N4 O4 S, 484.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
28M
Formula
C25 H32 N4 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

28M in 2 structures; the first of them:

  • 4MIB · Hepatitis C Virus polymerase NS5B genotype 1b (BK) in complex with Compound 48… · 28M A602 · binds PHE193, PRO197, ARG200, THR287, SER288, ASN291, ASN316, GLY317 and 13 more
  • 4MIB · Hepatitis C virus polymerase NS5B genotype 1B (bk) in complex with compound 48… · 28M A602 · binds PHE193, PRO197, ARG200, THR287, SER288, ASN291, ASN316, GLY317 and 13 more

Residues it binds most

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

Found with

  • DMS · Dimethyl sulfoxide

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