5UPJ: HIV-2 PROTEASE/U99283 complex

HIV-2 PROTEASE/U99283 complex. Determined by X-ray diffraction at 2.3 Å resolution. Released 21 Apr 1997.

Method
X-ray diffraction
Resolution
2.3 Å
Organism
Human immunodeficiency virus 2
Chains
2
Atoms
1,835
Mol. weight
21.74 kDa
Ligands
UIN
Released
21 Apr 1997

Explore 5UPJ in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

5UPJ contains 2 α-helices and 18 β-strands across 2 chains. Residue ranges use author residue numbering, as in the PDB file, from PDBe. To see them in 3D, choose the Cartoon representation with Secondary structure coloring: helices, sheets and coils get different colors.

Chain A: 1 helix, 9 β-strands

ElementResiduesLengthSheet
β-strand2-321
β-strand10-1562
β-strand18-2472
β-strand32-3322
β-strand42-4872
β-strand53-66142
β-strand69-7792
β-strand84-8522
α-helix87-937
β-strand96-9831
Chain B: 1 helix, 9 β-strands
ElementResiduesLengthSheet
β-strand2-431
β-strand10-1563
β-strand18-2473
β-strand32-3323
β-strand43-4973
β-strand52-66153
β-strand69-7793
β-strand84-8523
α-helix87-926
β-strand96-9831

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
HIV-2 proteaseA, Bprotein99Human immunodeficiency virus 2P04584
Sequence of entity 1 (A, B), FASTA
>5UPJ_1 HIV-2 PROTEASE (chains A, B)
PQFSLWKRPVVTAYIEGQPVEVLLDTGADDSIVAGIELGNNYSPKIVGGIGGFINTLEYK
NVEIEVLNKKVRATIMTGDTPINIFGRNILTALGMSLNL

Ligands and cofactors

IDNameFormulaCopies
UIN5,6,7,8,9,10-hexahydro-4-hydroxy-3-(1-phenylpropyl)cycloocta[b]pyran-2-oneC20 H24 O31

Primary citation

Use of medium-sized cycloalkyl rings to enhance secondary binding: discovery of a new class of human immunodeficiency virus (HIV) protease inhibitors. Romines, K.R., Watenpaugh, K.D., Tomich, P.K. et al. J Med Chem (1995) 38:1884-1891. DOI 10.1021/jm00011a008 · PubMed

Other PDB entries of the same protein (UniProt P04584), best resolution first:

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