GL1X · GenesisL1 explorer

Ligand · 0GQ

0GQ · 4-amino-N-{(1R,8R,9R,13R)-16-(4-amino-2-methylpyrimidin-5-yl)-1-benzyl-8-(cyclohexylmethyl)-9-hydroxy-13-[(1S)-1-methylpropyl]-2,6,11,14-tetraoxo-3,7,12,15-tetraazahexadec-1-yl}piperidine-1-carboxamide

0GQ, 4-amino-N-{(1R,8R,9R,13R)-16-(4-amino-2-methylpyrimidin-5-yl)-1-benzyl-8-(cyclohexylmethyl)-9-hydroxy-13-[(1S)-1-methylpropyl]-2,6,11,14-tetraoxo-3,7,12,15-tetraazahexadec-1-yl}piperidine-1-carboxamide (C41 H64 N10 O6, 793.0 g/mol)…

Component
0GQ
Formula
C41 H64 N10 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

0GQ in 2 structures; the first of them:

  • 1E80 · Endothiapepsin complex with renin inhibitor MERCK-KGAA-EMD56133 · 0GQ E327 · binds ILE7, ASP12, ALA13, ASP30, ASP32, GLY34, SER35, ILE73 and 17 more
  • 1E80 · Endothiapepsin complex with renin inhibitor merck-kgaa-EMD56133 · 0GQ E327 · binds ILE7, ASP12, ALA13, ASP30, ASP32, GLY34, SER35, ILE73 and 17 more

Residues it binds most

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

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