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Ligand · CQ7

CQ7 · 4-{[4-(cyclopentyloxy)-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino}-3-methoxy-N-methylbenzamide

CQ7, 4-{[4-(cyclopentyloxy)-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino}-3-methoxy-N-methylbenzamide (C28 H28 N6 O4, 512.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
CQ7
Formula
C28 H28 N6 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

CQ7 in 2 structures; the first of them:

  • 6B4W · TTK in Complex with Inhibitor · CQ7 A801 · binds LYS529, ILE531, GLY532, VAL539, GLN541, ALA551, LYS553, LEU575 and 18 more
  • 6B4W · Ttk in complex with inhibitor · CQ7 A801 · binds LYS529, ILE531, VAL539, GLN541, ALA551, LYS553, MET602, GLU603 and 9 more

Residues it binds most

ILE 2, MET 2, LYS 2, ALA 2, ASP 2, GLN 2, GLY 2, LEU 2, ASN 2, CYS 2 (residue and the binding sites it lines).

Found with

  • CAC · Cacodylate ion

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