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MolNFT v1 · #49627 · protein

Crystal structure of mouse ADP-ribosylhydrolase 3 (MARH3)

2QTY · POLY(ADP-ribose) glycohydrolase ARH3: “Crystal structure of mouse ADP-ribosylhydrolase 3 (MARH3)”. X-ray diffraction, 1 ligand (MG), 3 pockets (best druggability 0.70). MolNFT v1 #49627 on GenesisL1: 3D structure, binding sites and…

PDB
2QTY
Type
protein
Length
674 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
POLY(ADP-ribose) glycohydrolase ARH3
EC
3.2.1.143
UniProt
Q8CG72
Ligands
MG
Pockets
3 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 67% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPOLY(ADP-ribose) glycohydrolase ARH3 (EC 3.2.1.143)protein33767% helix, 1% strandQ8CG72

Ligands and binding sites

  • MG · Magnesium ion · metal · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16700.700.7876empty
21030.510.8229empty
31100.480.8026empty

Interfaces

1 interface between chains.

  • A–B · 500 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 2QTY · Crystal Structure of mouse ADP-ribosylhydrolase 3 (mARH3) · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8CG72 · AlphaFold monomer V2.0 prediction for ADP-ribose glycohydrolase ARH3 (Q8CG72) · a predicted model of the same protein · chain A against A, TM-score 0.99

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