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MolNFT v1 · #70725 · protein

Piracetam bound to the ligand binding domain of GLUA3

3LSX · GLUA3 S1S2 domain: “Piracetam bound to the ligand binding domain of GLUA3”. X-ray diffraction, 3 ligands (GLU, PZI, ZN), 2 pockets (best druggability 0.46). MolNFT v1 #70725 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
3LSX
Type
protein
Length
258 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
GLUA3 S1S2 domain
UniProt
P19492, Q9Z2W9
Ligands
GLU, PZI, ZN
Pockets
2 · best druggability 0.46

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGLUA3 S1S2 domainprotein25838% helix, 22% strandP19492, Q9Z2W9

Ligands and binding sites

  • GLU · Glutamic acid · ligand · chains A
  • PZI · 2-(2-oxopyrrolidin-1-yl)acetamide · ligand · chains A
  • ZN · Zinc ion · metal · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11630.460.7624empty
2850.350.7519empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 3LSX · Piracetam bound to the ligand binding domain of GluA3 · the same entry in another collection · chain A against A, TM-score 1.00
  • P19492 · AlphaFold monomer V2.0 prediction for glutamate receptor 3 (P19492) · a predicted model of the same protein · chain A against A, TM-score 0.95
  • Q9Z2W9 · AlphaFold monomer V2.0 prediction for glutamate receptor 3 (Q9Z2W9) · a predicted model of the same protein · chain A against A, TM-score 0.95

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