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Ligand · RWY

RWY · 2-(4-phenoxyphenoxy)ethyl thiocyanate

RWY, 2-(4-phenoxyphenoxy)ethyl thiocyanate (C15 H13 N O2 S, 271.3 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 most and the…

Component
RWY
Formula
C15 H13 N O2 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

RWY in 4 structures; the first of them:

  • 3WCD · The complex structure of HsSQS wtih ligand, WC-9 · RWY A401 · binds PHE54, TYR73, LEU76, ARG77, ASP80, VAL175, ALA176, VAL179 and 10 more
  • 4E9U · Crystal structure of dehydrosqualene synthase (Crtm) from S. aureus complexed with a… · RWY A301 · binds HIS18, SER19, PHE22, PHE26, TYR41, VAL133, ALA134, VAL137 and 10 more
  • 3WCD · The complex structure of hssqs wtih ligand, wc-9 · RWY A401 · binds PHE54, TYR73, LEU76, ARG77, ASP80, VAL175, ALA176, VAL179 and 10 more
  • 4E9U · Crystal structure of dehydrosqualene synthase (crtm) from S. aureus complexed with a… · RWY A301 · binds HIS18, SER19, PHE22, PHE26, TYR41, VAL133, ALA134, VAL137 and 10 more

Residues it binds most

LEU 10, GLY 10, PHE 10, VAL 10, ALA 10, GLN 10, TYR 10, ARG 8, CYS 8, MET 8 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion

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