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Ligand · XVM

XVM · Diethyl [(4-{(2S,3R)-4-{[(2H-1,3-benzodioxol-5-yl) sulfonyl][(2s)-2-methylbutyl]amino}-2-[({[(3r,3as, 6AR)-hexahydrofuro[2,3-b]furan-3-yl]oxy}carbonyl) amino]-3-hydroxybutyl}phenoxy)methyl]phosphonate

XVM, Diethyl [(4-{(2S,3R)-4-{[(2H-1,3-benzodioxol-5-yl) sulfonyl][(2s)-2-methylbutyl]amino}-2-[({[(3r,3as, 6AR)-hexahydrofuro[2,3-b]furan-3-yl]oxy}carbonyl) amino]-3-hydroxybutyl}phenoxy)methyl]phosphonate (C34 H49 N2 O13 P S, 756.8…

Component
XVM
Formula
C34 H49 N2 O13 P S
Class
ligand
Structures
4
PDB entries
2

Binding sites

XVM in 4 structures; the first of them:

  • 7LED · HIV-1 Protease WT (NL4-3) in Complex with PU4 (LR2-78) · XVM A103 · binds LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, ILE47 and 21 more
  • 7MAH · HIV-1 Protease (I84V) in Complex with PU4 (LR2-78) · XVM A103 · binds LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, ILE47 and 21 more
  • 7LED · HIV-1 protease wt (NL4-3) in complex with PU4 (LR2-78) · XVM A103 · binds ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, ILE47, GLY48 and 16 more
  • 7MAH · HIV-1 protease (I84V) in complex with PU4 (LR2-78) · XVM A103 · binds ASP25, GLY27, ALA28, ASP30, VAL32, ILE47, GLY48, GLY49 and 15 more

Residues it binds most

GLY 4, ASP 4, VAL 4, ILE 4, ALA 4, LEU 4, PRO 4, PHE 4, ARG 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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