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MolNFT v1 · #14677 · protein

Crystal structure analysis of deoxyribonucleotidase

1MH9: “Crystal structure analysis of deoxyribonucleotidase”. X-ray diffraction, 2 ligands (MG, PO4), 2 pockets (best druggability 0.72). MolNFT v1 #14677 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1MH9
Type
protein
Length
194 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Deoxyribonucleotidase
EC
3.1.3.5
UniProt
Q9NPB1
Ligands
MG, PO4
Pockets
2 · best druggability 0.72

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADeoxyribonucleotidase (EC 3.1.3.5)protein19436% helix, 15% strandQ9NPB1

Ligands and binding sites

  • MG · Magnesium ion · metal · chains A
  • PO4 · Phosphate ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12920.720.8630PO4, MG
2570.330.7619empty

Compared structures

  • 1MH9 · Crystal Structure Analysis of deoxyribonucleotidase · 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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