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Ligand · PI4

PI4 · 1-[2-(8-carbamoylmethyl-6,9-dioxo-2-oxa-7,10-diaza-bicyclo[11.2.2]heptadeca- 1(16),13(17),14-trien-11-yl)-2-hydroxy-ethyl]-piperidine-2-carboxylic acid tert-butylamide

PI4, 1-[2-(8-carbamoylmethyl-6,9-dioxo-2-oxa-7,10-diaza-bicyclo[11.2.2]heptadeca- 1(16),13(17),14-trien-11-yl)-2-hydroxy-ethyl]-piperidine-2-carboxylic acid tert-butylamide (C28 H43 N5 O6, 545.7 g/mol), in the MolNFT structures on…

Component
PI4
Formula
C28 H43 N5 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

PI4 in 2 structures; the first of them:

  • 1B6L · HIV-1 protease complexed with macrocyclic peptidomimetic inhibitor 4 · PI4 A201 · binds ASP25, GLY27, ALA28, ASP29, ASP30, ILE47, GLY48, GLY49 and 18 more
  • 1B6L · HIV-1 protease complexed with macrocyclic peptidomimetic inhibitor 4 · PI4 A201 · binds ASP25, GLY27, ALA28, ASP29, ASP30, ILE47, GLY48, GLY49 and 18 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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