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MolNFT v1 · #191483 · protein

Structure at 2.5-ångströms resolution of chemically synthesized human immunodeficiency virus type 1 protease complexed with a hydroxyethylene*-based inhibitor

8HVP · HIV-1 protease: “Structure at 2.5-ångströms resolution of chemically synthesized human immunodeficiency virus type 1 protease…”. X-ray diffraction. MolNFT v1 #191483 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
8HVP
Type
protein
Length
205 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
HIV-1 protease; Inhibitor val-ser-gln-asn-leu-PSI(CH(OH)-CH2)-val-ile-val (U-85548E)
UniProt
P03369

Structure

x-ray diffraction · 2 distinct chains · 4% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BHIV-1 proteaseprotein994% helix, 45% strandP03369
IInhibitor val-ser-gln-asn-leu-PSI(CH(OH)-CH2)-val-ile-val (U-85548E)protein70% helix, 43% strand—

Interfaces

3 interfaces between chains.

  • A–B · 1853 Ų buried · 31 hydrogen bonds · protein-protein
  • A–I · 533 Ų buried · 10 hydrogen bonds · protein-protein
  • B–I · 473 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 modified (nonstandard).

Compared structures

  • 8HVP · Structure at 2.5-ångströms resolution of chemically synthesized human immunodeficiency… · the same entry in another collection · chain A against A, TM-score 1.00

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