0QS · N~2~-[(2R)-2-benzyl-3-(tert-butylsulfonyl)propanoyl]-N-{(1R)-1-(cyclohexylmethyl)-3,3-difluoro-2,2-dihydroxy-4-[(2-morpholin-4-ylethyl)amino]-4-oxobutyl}-3-(1H-imidazol-3-ium-4-yl)-L-alaninamide

Binding sites

0QS in 10 structures; the first of them:

• 1EPR · Endothia aspartic proteinase (endothiapepsin) complexed with pd-135,040 · 0QS E331 · binds ILE7, ASP12, ALA13, ASP30, ASP32, GLY34, SER35, SER74 and 17 more
• 1OD1 · Endothiapepsin PD135,040 complex · 0QS A400 · binds ILE10, ASP15, ALA16, ASP33, ASP35, GLY37, SER38, ILE77 and 20 more
• 2JJI · Endothiapepsin in complex with a gem-diol inhibitor. · 0QS A331 · binds ILE10, ASP15, ALA16, ASP33, ASP35, GLY37, SER38, ILE77 and 21 more
• 2JJJ · Endothiapepsin in complex with a gem-diol inhibitor. · 0QS A331 · binds ILE10, ASP15, ALA16, ASP33, ASP35, GLY37, SER38, ILE77 and 21 more
• 2VS2 · Neutron diffraction structure of endothiapepsin in complex with a gem- diol inhibitor. · 0QS A400 · binds ILE10, ASP15, ALA16, ASP33, ASP35, GLY37, SER38, SER78 and 19 more
• 1EPR · Endothia aspartic proteinase (endothiapepsin) complexed with pd-135, 040 · 0QS E331 · binds ILE7, ASP12, ALA13, ASP30, ASP32, GLY34, SER35, SER74 and 17 more
• 1OD1 · Endothiapepsin PD135,040 complex · 0QS A400 · binds ILE10, ASP15, ALA16, ASP33, ASP35, GLY37, SER38, ILE77 and 20 more
• 2JJI · Endothiapepsin in complex with a gem-diol inhibitor. · 0QS A331 · binds ILE10, ASP15, ALA16, ASP33, ASP35, GLY37, SER38, ILE77 and 21 more
• 2JJJ · Endothiapepsin in complex with a gem-diol inhibitor. · 0QS A331 · binds ILE10, ASP15, ALA16, ASP33, ASP35, GLY37, SER38, ILE77 and 21 more
• 2VS2 · Neutron diffraction structure of endothiapepsin in complex with a gem- diol inhibitor. · 0QS A400 · binds ILE10, ASP15, ALA16, ASP33, ASP35, GLY37, SER38, SER78 and 19 more

Residues it binds most

ASP 10, ILE 10, GLY 10, SER 10, LEU 10, THR 10, PHE 10, TYR 10, ALA 10 (residue and the binding sites it lines).

Found with

• SO4 · Sulfate ion
• SUI · (3-amino-2,5-dioxo-1-pyrrolidinyl)acetic acid