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MolNFT v1 · #54559 · protein

Crystal structure of human nudix motif 16 (NUDT16) in complex with imp and magnesium

2XSQ · U8 snorna-decapping enzyme: “Crystal structure of human nudix motif 16 (NUDT16) in complex with imp and magnesium”. X-ray diffraction, 3 ligands (IMP, MG, CL), 1 pocket (best druggability 0.54). MolNFT v1 #54559 on GenesisL1: 3D…

PDB
2XSQ
Type
protein
Length
179 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
U8 snorna-decapping enzyme
EC
3.6.1.-
UniProt
Q96DE0
Ligands
IMP, MG, CL
Pockets
1 · best druggability 0.54

Structure

x-ray diffraction · 1 distinct chain · 30% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AU8 snorna-decapping enzyme (EC 3.6.1.-)protein17930% helix, 34% strandQ96DE0

Ligands and binding sites

  • IMP · Inosinic acid · ligand · chains A
  • MG · Magnesium ion · metal · 2 copies · chains A
  • CL · Chloride ion · ion · 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
12340.540.7730IMP, MG

Compared structures

  • 2XSQ · Crystal structure of human Nudix motif 16 (NUDT16) in complex with IMP and magnesium · the same entry in another collection · chain A against A, TM-score 1.00
  • Q96DE0 · AlphaFold monomer V2.0 prediction for U8 snorna-decapping enzyme (Q96DE0) · a predicted model of the same protein · chain A against A, TM-score 0.99

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