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Ligand · XH0

XH0 · 2-{(R)-2-[1-(3-{2-[(5-methyl-2H-tetrazol-2-yl)methyl]-4-(trifluoromethyl)phenyl}propanoyl)piperidin-4-yl]ethanesulfinyl}-1,3-thiazole-5-sulfonamide

XH0, 2-{(R)-2-[1-(3-{2-[(5-methyl-2H-tetrazol-2-yl)methyl]-4-(trifluoromethyl)phenyl}propanoyl)piperidin-4-yl]ethanesulfinyl}-1,3-thiazole-5-sulfonamide (C23 H28 F3 N7 O4 S3, 619.7 g/mol), in the MolNFT structures on GenesisL1: bound in 1…

Component
XH0
Formula
C23 H28 F3 N7 O4 S3
Class
ligand
Structures
1
PDB entries
1

Binding sites

XH0 in 1 structure; the first of them:

  • 7G2Y · Crystal Structure of rat Autotaxin in complex with… · XH0 A904 · binds ILE167, SER169, ASP171, LYS208, THR209, PHE210, LEU213, TYR214 and 15 more

Residues it binds most

HIS 1, LEU 1, PHE 1, TRP 1, ALA 1, ASP 1, TYR 1, ASN 1, ILE 1, LYS 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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