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The structure of the neurotropic AAVRH.8 viral vector

Analyse The structure of the neurotropic AAVRH.8 viral vector in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4RSO
Type
protein
Length
520 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein VP1
UniProt
Q808Y3
Ligands
DA, NA, CL
Pockets
6 · best druggability 0.68

Structure

x-ray diffraction · 1 distinct chain · 6% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACapsid protein VP1protein5206% helix, 34% strandQ808Y3

Ligands and binding sites

  • DA · 2'-deoxyadenosine-5'-monophosphate · ligand · chains A
  • NA · Sodium ion · metal · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

6 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16590.680.7678CL
21980.460.7434empty
31120.420.7723DA
4670.340.7718empty
5910.330.7315empty

Compared structures

  • 4RSO · The structure of the neurotropic AAVrh.8 viral vector · the same entry in another collection · chain A against A, TM-score 1.00

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