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Ligand · CWC

CWC · 4-(dimethylamino)-N-[5-(1H-indol-4-yl)pyridin-3-yl]butanamide

CWC, 4-(dimethylamino)-N-[5-(1H-indol-4-yl)pyridin-3-yl]butanamide (C19 H22 N4 O, 322.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
CWC
Formula
C19 H22 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

CWC in 2 structures; the first of them:

  • 5AIS · Complex of human hematopoietic prostagandin D2 synthase (hH-PGDS) in complex with an… · CWC A1200 · binds TYR8, PHE9, MET11, GLY13, ARG14, GLN36, ASP96, MET99 and 6 more
  • 5AIS · Complex of human hematopoietic prostagandin D2 synthase (hh- pgds) in complex with an… · CWC A1200 · binds TYR8, PHE9, MET11, GLY13, ARG14, GLN36, ASP96, MET99 and 6 more

Residues it binds most

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

Found with

  • GSH · Glutathione
  • MG · Magnesium ion

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