GL1X · GenesisL1 explorer

Ligand · PI5

PI5 · N-[3-(8-sec-butyl-7,10-dioxo-2-oxa-6,9-diaza-bicyclo[11.2.2]heptadeca-1(16),13(17),14- trien-11-ylamino)-2-hydroxy-1-(4-hydroxy-benzyl)-propyl]-3-methyl-2- (2-oxo-pyrrolidin-1-yl)-butyramide

PI5, N-[3-(8-sec-butyl-7,10-dioxo-2-oxa-6,9-diaza-bicyclo[11.2.2]heptadeca-1(16),13(17),14- trien-11-ylamino)-2-hydroxy-1-(4-hydroxy-benzyl)-propyl]-3-methyl-2- (2-oxo-pyrrolidin-1-yl)-butyramide (C37 H53 N5 O7, 679.9 g/mol), in the MolNFT…

Component
PI5
Formula
C37 H53 N5 O7
Class
ligand
Structures
2
PDB entries
1

Binding sites

PI5 in 2 structures; the first of them:

  • 1B6K · HIV-1 protease complexed with macrocyclic peptidomimetic inhibitor 5 · PI5 A201 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 22 more
  • 1B6K · HIV-1 protease complexed with macrocyclic peptidomimetic inhibitor 5 · PI5 A201 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 22 more

Residues it binds most

ASP 2, GLY 2, ILE 2, VAL 2, ALA 2, ARG 2, LEU 2, PRO 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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