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MolNFT v1 · #29304 · protein

Structure of the D41N variant of the human mitochondrial deoxyribonucleotidase in complex with thymidine 3'-monophosphate

1Z4K · 5'(3')-deoxyribonucleotidase: “Structure of the D41N variant of the human mitochondrial deoxyribonucleotidase in complex with thymidine…”. X-ray diffraction, 2 ligands (T3P, MG), 1 pocket (best druggability 0.71). MolNFT v1 #29304…

PDB
1Z4K
Type
protein
Length
194 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'(3')-deoxyribonucleotidase
EC
3.1.3.-
UniProt
Q9NPB1
Ligands
T3P, MG
Pockets
1 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'(3')-deoxyribonucleotidase (EC 3.1.3.-)protein19435% helix, 15% strandQ9NPB1

Ligands and binding sites

  • T3P · Thymidine-3'-phosphate · 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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13070.710.8446T3P

Compared structures

  • 1Z4K · Structure of the D41N variant of the human mitochondrial deoxyribonucleotidase in complex… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9NPB1 · AlphaFold monomer V2.0 prediction for 5'(3')-deoxyribonucleotidase, mitochondrial (Q9NPB1) · a predicted model of the same protein · chain A against A, TM-score 1.00

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