GL1X · GenesisL1 explorer

Ligand · 646

646 · 2,6-dichloro-4-(2-piperazin-1-ylpyridin-4-yl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzenesulfonamide

646, 2,6-dichloro-4-(2-piperazin-1-ylpyridin-4-yl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzenesulfonamide (C21 H24 Cl2 N6 O2 S, 495.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
646
Formula
C21 H24 Cl2 N6 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

646 in 2 structures; the first of them:

  • 6MAZ · Crystal structure of N-myristoyl transferase (NMT) G386E mutant from Plasmodium vivax in… · 646 A503 · binds TYR95, VAL96, GLU97, ASP98, PHE103, ARG104, PHE105, TYR107 and 15 more
  • 6MAZ · Crystal structure of N-myristoyl transferase (nmt) G386E mutant from plasmodium vivax in… · 646 A503 · binds TYR95, VAL96, GLU97, ASP98, PHE103, ARG104, PHE105, ASN161 and 11 more

Residues it binds most

TYR 6, LEU 6, PHE 6, GLU 6, ASP 6, ARG 6, ASN 6, GLY 6, HIS 6, SER 6 (residue and the binding sites it lines).

Found with

  • YNC · Tetradec-13-ynoic acid - coa thioester
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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