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MolNFT v1 · #179776 · protein

Adeno-associated virus (aav-dj) - cryo-EM structure at 1.56 ångström resolution

7KFR · Capsid protein VP1: “Adeno-associated virus (aav-dj) - cryo-EM structure at 1.56 ångström resolution”. Electron microscopy, 1 ligand (MG), 6 pockets (best druggability 0.71). MolNFT v1 #179776 on GenesisL1: 3D structure, binding…

PDB
7KFR
Type
protein
Length
521 residues
Chains
1
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein VP1
UniProt
Q6JC41
Ligands
MG
Pockets
6 · best druggability 0.71

Structure

electron microscopy · 1 distinct chain · 8% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACapsid protein VP1protein5218% helix, 34% strandQ6JC41

Ligands and binding sites

  • MG · Magnesium ion · metal · 3 copies · 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
19210.710.7595empty
21180.450.7826empty
31340.400.7423empty
41180.390.7418empty
5680.330.7619empty

Compared structures

  • 7KFR · Adeno-Associated Virus (AAV-DJ) - cryo-EM structure at 1.56 Angstrom Resolution · the same entry in another collection · chain A against A, TM-score 1.00

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