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MolNFT v1 · #143383 · protein

Structure of the V11I/T58A/I124A mutant of the HIV-1 capsid protein

6AXY: “Structure of the V11I/T58A/I124A mutant of the HIV-1 capsid protein”. X-ray diffraction, 2 ligands (CL, IOD), 1 pocket (best druggability 0.34). MolNFT v1 #143383 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6AXY
Type
protein
Length
216 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
HIV-1 capsid protein
UniProt
B6DRA0
Ligands
CL, IOD
Pockets
1 · best druggability 0.34

Structure

x-ray diffraction · 1 distinct chain · 61% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHIV-1 capsid proteinprotein21661% helix, 2% strandB6DRA0

Ligands and binding sites

  • CL · Chloride ion · ion · 9 copies · chains A
  • IOD · Iodide ion · ion · 7 copies · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1670.340.7617empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 6AXY · Structure of the V11I/T58A/I124A mutant of the HIV-1 capsid protein · the same entry in another collection · chain A against A, TM-score 1.00

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