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MolNFT v1 · #168368 · protein

HIV integrase core domain in complex with inhibitor 3-methyl-2-{5- methyl-2-[2-(thiophen-2-YL)ETHYNYL]-1- benzofuran-3-YL}BUTANOIC acid

6WE7: “HIV integrase core domain in complex with inhibitor 3-methyl-2-{5- methyl-2-[2-(thiophen-2-YL)ETHYNYL]-1…”. X-ray diffraction, 3 ligands (TXM, SO4, IOD). MolNFT v1 #168368 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6WE7
Type
protein
Length
133 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
F2WR52
Ligands
TXM, SO4, IOD

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein133—F2WR52

Ligands and binding sites

  • TXM · (2S)-3-methyl-2-{5-methyl-2-[(thiophen-2-yl)ethynyl]-1-benzofuran-3-yl}butanoic acid · ligand · chains A
  • SO4 · Sulfate ion · ion · 5 copies · chains A
  • IOD · Iodide ion · ion · 2 copies · chains A

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

Compared structures

  • 6WE7 · HIV Integrase core domain in complex with inhibitor… · the same entry in another collection · chain A against A, TM-score 1.00

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