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MolNFT v1 · #159174 · protein

X-ray crystal structure of darunavir-resistant HIV-1 protease (P30) in complex with grl-142

6OGR: “X-ray crystal structure of darunavir-resistant HIV-1 protease (P30) in complex with grl-142”. X-ray diffraction, 1 ligand (7OA). MolNFT v1 #159174 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6OGR
Type
protein
Length
99 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
O38885
Ligands
7OA

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein99—O38885

Ligands and binding sites

  • 7OA · (3S,3aR,5R,7aS,8S)-hexahydro-4H-3,5-methanofuro[2,3-b]pyran-8-yl [(2S,3R)-4-[{[2-(cyclopropylamino)-1,3-benzothiazol-6-yl]sulfonyl}(2-methylpropyl)amino]-1-(3,5-difluorophenyl)-3-hydroxybutan-2-yl]carbamate · ligand · chains A
  • EDO · 1,2-ethanediol · additive · chains A

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

Compared structures

  • 6OGR · X-ray crystal structure of darunavir-resistant HIV-1 protease (P30) in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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