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MolNFT v1 · #156224 · protein

X-ray structure of human pparalpha ligand binding domain-palmitic acid co-crystals obtained by delipidation and cross-seeding

6LX6 · Peroxisome proliferator-activated receptor alpha: “X-ray structure of human pparalpha ligand binding domain-palmitic acid co-crystals obtained by delipidation…”. X-ray diffraction, 1 ligand (PLM), 3 pockets (best druggability 0.82).…

PDB
6LX6
Type
protein
Length
264 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Peroxisome proliferator-activated receptor alpha
UniProt
Q07869
Ligands
PLM
Pockets
3 · best druggability 0.82

Structure

x-ray diffraction · 1 distinct chain · 69% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APeroxisome proliferator-activated receptor alphaprotein26469% helix, 5% strandQ07869

Ligands and binding sites

  • PLM · Palmitic acid · ligand · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14420.820.8959PLM
2510.310.7710empty
3680.300.7411empty

Compared structures

  • 6LX6 · X-ray structure of human PPARalpha ligand binding domain-palmitic acid co-crystals… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q07869 · AlphaFold monomer V2.0 prediction for peroxisome proliferator- activated receptor alpha… · a predicted model of the same protein · chain A against A, TM-score 0.97

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