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MolNFT v1 · #149401 · protein

Ppar gamma mutant complex

6FZG · Peroxisome proliferator-activated receptor gamma: “Ppar gamma mutant complex”. X-ray diffraction, 2 ligands (EDK, CL), 3 pockets (best druggability 0.83). MolNFT v1 #149401 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6FZG
Type
protein
Length
276 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Peroxisome proliferator-activated receptor gamma
UniProt
P37231
Ligands
EDK, CL
Pockets
3 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 64% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APeroxisome proliferator-activated receptor gammaprotein27664% helix, 5% strandP37231

Ligands and binding sites

  • EDK · (2~{S})-3-[4-[2-[methyl(pyridin-2-yl) amino]ethoxy]phenyl]-2-[[2-(phenylcarbonyl) phenyl]amino]propanoic acid · ligand · chains A
  • CL · Chloride ion · ion · 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
14930.830.9053EDK
2910.420.7816empty
3650.330.7514empty

Compared structures

  • 6FZG · PPAR gamma mutant complex · the same entry in another collection · chain A against A, TM-score 1.00

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