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HIV-1 capsid C-terminal domain in complex with an inhibitor of particle assembly

Analyse HIV-1 capsid C-terminal domain in complex with an inhibitor of particle assembly in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2BUO
Type
protein
Length
96 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
HIV-1 capsid protein; Inhibitor of capsid assembly
UniProt
Q72497

Structure

x-ray diffraction · 2 distinct chains · 59% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHIV-1 capsid proteinprotein8458% helix, 0% strandQ72497
TInhibitor of capsid assemblyprotein1267% helix, 0% strand—

Ligands and binding sites

  • ACY · Acetic acid · additive · chains A, T

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

Interfaces

1 interface between chains.

  • A–T · 658 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 2BUO · HIV-1 capsid C-terminal domain in complex with an inhibitor of particle assembly · the same entry in another collection · chain A against A, TM-score 1.00

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