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Crystal structure of ankg LIR/GABARAPL1 complex

Analyse Crystal structure of ankg LIR/GABARAPL1 complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5YIP
Type
protein
Length
146 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Gamma-aminobutyric acid receptor-associated protein-like 1; Ankyrin-3
UniProt
Q8R3R8, O70511
Pockets
1 · best druggability 0.33

Structure

x-ray diffraction · 2 distinct chains · 34% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGamma-aminobutyric acid receptor-associated protein-like 1protein12332% helix, 21% strandQ8R3R8
BAnkyrin-3protein2343% helix, 4% strandO70511

Ligands and binding sites

  • GOL · Glycerol · additive · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1790.330.7424empty

Interfaces

1 interface between chains.

  • A–B · 894 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 5YIP · Crystal Structure of AnkG LIR/GABARAPL1 complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8R3R8 · AlphaFold monomer V2.0 prediction for gamma-aminobutyric acid receptor-associated… · a predicted model of the same protein · chain A against A, TM-score 0.92
  • O70511 · AlphaFold monomer V2.0 prediction for ankyrin-3 (O70511) · a predicted model of the same protein · chain B against A, TM-score 0.52

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