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Ligand · HFS

HFS · 1-(1-hydroxy-5-isoquinolinesulfonyl)homopiperazine

HFS, 1-(1-hydroxy-5-isoquinolinesulfonyl)homopiperazine (C14 H17 N3 O3 S, 307.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
HFS
Formula
C14 H17 N3 O3 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

HFS in 4 structures; the first of them:

  • 2ERZ · Crystal Structure of c-AMP Dependent Kinase (PKA) bound to hydroxyfasudil · HFS E351 · binds LEU49, THR51, GLY52, VAL57, ALA70, LYS72, VAL104, MET120 and 11 more
  • 2ETK · Crystal Structure of ROCK 1 bound to hydroxyfasudil · HFS A416 · binds ILE82, VAL90, ALA103, LYS105, VAL137, MET153, GLU154, TYR155 and 7 more
  • 2ERZ · Crystal structure of C-AMP dependent kinase (PKA) bound to hydroxyfasudil · HFS E351 · binds LEU49, THR51, GLY52, VAL57, ALA70, LYS72, VAL104, MET120 and 11 more
  • 2ETK · Crystal structure of rock 1 bound to hydroxyfasudil · HFS A416 · binds ILE82, VAL90, ALA103, LYS105, VAL137, MET153, GLU154, TYR155 and 7 more

Residues it binds most

VAL 6, ALA 6, ASP 6, GLU 6, MET 6, LEU 6, ASN 6, LYS 6, PHE 6, TYR 6 (residue and the binding sites it lines).

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