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Ligand · XVB

XVB · 6-[(3aR,6aS)-5-{2-cyclopropyl-6-[(oxan-4-yl)methoxy]pyridine-4-carbonyl}hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carbonyl]pyridine-3-sulfonamide

XVB, 6-[(3aR,6aS)-5-{2-cyclopropyl-6-[(oxan-4-yl)methoxy]pyridine-4-carbonyl}hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carbonyl]pyridine-3-sulfonamide (C27 H33 N5 O6 S, 555.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1…

Component
XVB
Formula
C27 H33 N5 O6 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

XVB in 1 structure; the first of them:

  • 7G7T · Crystal Structure of rat Autotaxin in complex with… · XVB A901 · binds ILE167, ASP171, THR209, PHE210, LEU213, TYR214, LEU216, ALA217 and 9 more

Residues it binds most

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