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MolNFT v1 · #73160 · protein

Structural insights of adeno-associated virus 5. a gene therapy vector for cystic fibrosis

3NTT · Capsid protein: “Structural insights of adeno-associated virus 5. a gene therapy vector for cystic fibrosis”. X-ray diffraction, 1 ligand (NA), 4 pockets (best druggability 0.68). MolNFT v1 #73160 on GenesisL1: 3D structure, binding…

PDB
3NTT
Type
protein
Length
516 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein
UniProt
Q9YIJ1
Ligands
NA
Pockets
4 · best druggability 0.68

Structure

x-ray diffraction · 1 distinct chain · 7% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACapsid proteinprotein5167% helix, 33% strandQ9YIJ1

Ligands and binding sites

  • NA · Sodium ion · metal · 3 copies · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16250.680.7761GOL
23300.540.7444empty
31420.490.7825empty
41730.440.7425empty

Compared structures

  • 3NTT · Structural insights of Adeno-Associated virus 5. A gene therapy Vector for Cystic Fibrosis · the same entry in another collection · chain A against A, TM-score 1.00

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