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MolNFT v1 · #140855 · protein

Structure of A17 HIV-1 protease in complex with inhibitor kni-1657

5YOJ: “Structure of A17 HIV-1 protease in complex with inhibitor kni-1657”. X-ray diffraction, 1 ligand (8Z0). MolNFT v1 #140855 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5YOJ
Type
protein
Length
198 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Ligands
8Z0

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein99——

Ligands and binding sites

  • 8Z0 · (4R)-N-[(2,6-dimethylphenyl)methyl]-3-[(2S,3S)-3-[[(2S)-2-[(7-methoxy-1-benzofuran-2-yl)carbonylamino]-2-[(3R)-oxolan-3-yl]ethanoyl]amino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide · ligand · chains A, B
  • GOL · Glycerol · additive · 2 copies · chains B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 5YOJ · Structure of A17 HIV-1 Protease in Complex with Inhibitor KNI-1657 · the same entry in another collection · chain A against A, TM-score 1.00

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