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Ligand · YNB

YNB · [2-methyl-4-(trifluoromethoxy)phenyl]methyl (8R)-2-(1,4,6,7-tetrahydro-5H-[1,2,3]triazolo[4,5-c]pyridine-5-carbonyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-5(4H)-carboxylate

YNB, [2-methyl-4-(trifluoromethoxy)phenyl]methyl (8R)-2-(1,4,6,7-tetrahydro-5H-[1,2,3]triazolo[4,5-c]pyridine-5-carbonyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-5(4H)-carboxylate (C22 H22 F3 N7 O4, 505.4 g/mol), in the MolNFT structures on…

Component
YNB
Formula
C22 H22 F3 N7 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

YNB in 1 structure; the first of them:

  • 7G4H · Crystal Structure of rat Autotaxin in complex with… · YNB A901 · binds ILE167, SER169, ASP171, PHE210, LEU213, LEU216, ALA217, TRP260 and 11 more

Residues it binds most

PHE 1, ALA 1, ASP 1, LEU 1, TRP 1, VAL 1, GLU 1, ILE 1, MET 1, SER 1 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • K · Potassium ion
  • NA · Sodium ion
  • ZN · Zinc ion
  • BMA · beta-D-mannopyranose
  • MAN · alpha-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • CL · Chloride ion
  • ACT · Acetate ion

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