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MolNFT v1 · #116673 · protein

N-terminal his tagged appol exonuclease mutant

5DKT · Prex DNA polymerase: “N-terminal his tagged appol exonuclease mutant”. X-ray diffraction, 2 ligands (NA, SO4), 9 pockets (best druggability 0.70). MolNFT v1 #116673 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5DKT
Type
protein
Length
577 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Prex DNA polymerase
EC
2.7.7.7
UniProt
Q8ILY1
Ligands
NA, SO4
Pockets
9 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 47% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APrex DNA polymerase (EC 2.7.7.7)protein57747% helix, 17% strandQ8ILY1

Ligands and binding sites

  • NA · Sodium ion · metal · chains A
  • SO4 · Sulfate ion · ion · 9 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1530.700.9819empty
26080.690.7860SO4, NA
31250.470.7826empty
41130.470.7921empty
5610.420.8114empty

Compared structures

  • 5DKT · N-terminal His tagged apPOL exonuclease mutant · the same entry in another collection · chain A against A, TM-score 1.00

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