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MolNFT v2 · #219205 · protein

In meso structure of apolipoprotein N-acyltransferase, Lnt, from Escherichia coli in 7.10 monoacylglycerol

8RQR: “In meso structure of apolipoprotein N-acyltransferase, Lnt, from Escherichia coli in 7.10 monoacylglycerol”. X-ray diffraction at 2.19, 1 ligand (A1H2K), 3 pockets (best druggability 0.76). MolNFT v2 #219205 on GenesisL1: 3D…

PDB
8RQR
Type
protein
Length
511 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.19
Source
Escherichia coli
Molecule
Apolipoprotein N-acyltransferase
EC
2.3.1.269
UniProt
P23930
Ligands
A1H2K
Pockets
3 · best druggability 0.76

Structure

x-ray diffraction · resolution 2.19 · 1 distinct chain · 53% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AApolipoprotein N-acyltransferase (EC 2.3.1.269)protein51153% helix, 16% strandP23930

Ligands and binding sites

  • A1H2K · 7.10 monoacylglycerol (S-form) · ligand · 8 copies · chains A
  • GOL · Glycerol · additive · 4 copies · 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18500.760.7968A1H2K
21960.620.8329empty
3650.330.7513empty

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