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The walker-type ATPase PABY2304 of pyrococcus abyssi

Analyse The walker-type ATPase PABY2304 of pyrococcus abyssi in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2QEN
Type
protein
Length
350 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Walker-type ATPase
UniProt
Q9V2L3
Ligands
ADP, MG
Pockets
3 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 59% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AWalker-type ATPaseprotein35059% helix, 11% strandQ9V2L3

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15510.740.8251MG, ADP
21760.470.7518empty
3830.330.7418empty

Compared structures

  • 2QEN · The walker-type atpase paby2304 of pyrococcus abyssi · the same entry in another collection · chain A against A, TM-score 1.00

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