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Ligand · QTI

QTI · 3-[4-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]sulfonylbenzenesulfonamide

QTI, 3-[4-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]sulfonylbenzenesulfonamide (C21 H22 F N3 O4 S3, 495.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component
QTI
Formula
C21 H22 F N3 O4 S3
Class
ligand
Structures
1
PDB entries
1

Binding sites

QTI in 1 structure; the first of them:

  • 8BL0 · Human Sirt6 in complex with the inhibitor S6023 and ADP-ribose · QTI A403 · binds ALA53, SER56, ILE61, PRO62, ASP63, PHE64, VAL70, TRP71 and 12 more

Residues it binds most

ASP 2, PHE 2, ILE 2, MET 2, TRP 2, VAL 2, ALA 2, ASN 2, HIS 2, LEU 2 (residue and the binding sites it lines).

Found with

  • AR6 · [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl [hydroxy-[[(2R,3S,4R,5S)-3,4,5-trihydroxyoxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate
  • ZN · Zinc ion
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • PEG · Di(hydroxyethyl)ether

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