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Partition protein-ADP complex

Analyse Partition protein-ADP complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3EZ2
Type
protein
Length
782 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Plasmid partition protein a
UniProt
P07620
Ligands
ADP, MG
Pockets
6 · best druggability 0.80

Structure

x-ray diffraction · 2 distinct chains · 53% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APlasmid partition protein aprotein38852% helix, 12% strandP07620
BPlasmid partition protein aprotein39453% helix, 13% strandP07620

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · 4 copies · chains A, B
  • MG · Magnesium ion · metal · 2 copies · chains A, B
  • GOL · Glycerol · additive · 2 copies · chains B
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid · additive · chains B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18850.800.8291ADP, MG
22490.710.8641ADP
33190.640.8029empty
4940.420.7824empty
5600.330.7716empty

Interfaces

1 interface between chains.

  • A–B · 2795 Ų buried · 20 hydrogen bonds · protein-protein

Compared structures

  • 3EZ2 · Partition protein-ADP complex · the same entry in another collection · chain A against A, TM-score 1.00
  • P07620 · AlphaFold monomer V2.0 prediction for plasmid partition protein a (P07620) · a predicted model of the same protein · chain A against A, TM-score 0.95

Analyse

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