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MolNFT v1 · #139550 · protein

Crystal structure of plsy (ygih), an integral membrane glycerol 3- phosphate acyltransferase - the acyl phosphate form

5XJ7 · Glycerol-3-phosphate acyltransferase: “Crystal structure of plsy (ygih), an integral membrane glycerol 3- phosphate acyltransferase - the acyl…”. X-ray diffraction, 4 ligands (78M, 87O, K), 1 pocket (best druggability 0.78). MolNFT…

PDB
5XJ7
Type
protein
Length
193 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycerol-3-phosphate acyltransferase
EC
2.3.1.-
UniProt
O66905
Ligands
78M, 87O, K, PO4
Pockets
1 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 74% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycerol-3-phosphate acyltransferase (EC 2.3.1.-)protein19374% helix, 0% strandO66905

Ligands and binding sites

  • 78M · (2S)-2,3-dihydroxypropyl(7z)-pentadec-7-enoate · ligand · 7 copies · chains A
  • 87O · phosphono hexadecanoate · ligand · 2 copies · chains A
  • K · Potassium ion · metal · 2 copies · chains A
  • PO4 · Phosphate 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
14800.780.856178M, 87O, K, PO4

Modifications

Observed in the structure: 1 modified (formylation).

Compared structures

  • 5XJ7 · Crystal structure of PlsY (YgiH), an integral membrane glycerol 3-phosphate… · the same entry in another collection · chain A against A, TM-score 1.00
  • O66905 · AlphaFold monomer V2.0 prediction for glycerol-3-phosphate acyltransferase (O66905) · a predicted model of the same protein · chain A against A, TM-score 0.98

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