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HIV-1 integrase catalytic core domain A128T mutant complexed with allosteric inhibitor

Analyse HIV-1 integrase catalytic core domain A128T mutant complexed with allosteric… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4JLH
Type
protein
Length
140 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
HIV-1 integrase catalytic core domain
UniProt
P12497
Ligands
0L9, SO4

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHIV-1 integrase catalytic core domainprotein14050% helix, 23% strandP12497

Ligands and binding sites

  • 0L9 · (2S)-[6-bromo-4-(4-chlorophenyl)-2-methylquinolin-3-yl](methoxy)ethanoic acid · ligand · chains A
  • SO4 · Sulfate ion · ion · chains A

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

Modifications

Observed in the structure: 2 modified (nonstandard).

Compared structures

  • 4JLH · HIV-1 Integrase Catalytic Core Domain A128T Mutant Complexed with Allosteric Inhibitor · the same entry in another collection · chain A against A, TM-score 1.00

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