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Ligand · 2Y2

2Y2 · N-[(2R)-1-{[(2S,3R,5R)-1-cyclohexyl-3-hydroxy-5-{[2-(morpholin-4-yl)ethyl]carbamoyl}oct-7-yn-2-yl]amino}-3-(methylsulfa nyl)-1-oxopropan-2-yl]-1H-benzimidazole-2-carboxamide

2Y2, N-[(2R)-1-{[(2S,3R,5R)-1-cyclohexyl-3-hydroxy-5-{[2-(morpholin-4-yl)ethyl]carbamoyl}oct-7-yn-2-yl]amino}-3-(methylsulfa nyl)-1-oxopropan-2-yl]-1H-benzimidazole-2-carboxamide (C33 H48 N6 O5 S, 640.8 g/mol), in the MolNFT structures on…

Component
2Y2
Formula
C33 H48 N6 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

2Y2 in 2 structures; the first of them:

  • 1FQ4 · Crystal structure of a complex between hydroxyethylene inhibitor cp-108,420 and yeast… · 2Y2 A338 · binds ALA12, GLN13, ILE30, ASP32, GLY34, SER35, ILE73, GLN74 and 17 more
  • 1FQ4 · Crystal structure of a complex between hydroxyethylene inhibitor cp- 108,420 and yeast… · 2Y2 A338 · binds ALA12, GLN13, ILE30, ASP32, GLY34, SER35, ILE73, GLN74 and 17 more

Residues it binds most

ILE 2, THR 2, GLY 2, ASP 2, GLN 2, PHE 2, SER 2, TYR 2, ALA 2, MET 2 (residue and the binding sites it lines).

Found with

  • BGC · beta-D-glucopyranose
  • BMA · beta-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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