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Crystal structure of ATG101-ATG13HORMA

Analyse Crystal structure of ATG101-ATG13HORMA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5XUY
Type
protein
Length
784 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Autophagy-related protein 13; Autophagy-related protein 101
UniProt
O75143, Q9BSB4
Pockets
4 · best druggability 0.74

Structure

x-ray diffraction · 4 distinct chains · 34% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAutophagy-related protein 13protein18033% helix, 28% strandO75143
BAutophagy-related protein 101protein20533% helix, 33% strandQ9BSB4
CAutophagy-related protein 13protein18435% helix, 30% strandO75143
DAutophagy-related protein 101protein21534% helix, 32% strandQ9BSB4

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15870.740.8174empty
22580.660.8335empty
31010.360.7418empty
4750.340.7517empty

Interfaces

5 interfaces between chains.

  • A–B · 1406 Ų buried · 24 hydrogen bonds · protein-protein
  • C–D · 1371 Ų buried · 25 hydrogen bonds · protein-protein
  • B–C · 318 Ų buried · 1 hydrogen bond · protein-protein
  • A–D · 278 Ų buried · 0 hydrogen bonds · protein-protein
  • B–D · 42 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 5XUY · Crystal structure of ATG101-ATG13HORMA · the same entry in another collection · chain D against D, TM-score 1.00
  • O75143 · AlphaFold monomer V2.0 prediction for autophagy-related protein 13 (O75143) · a predicted model of the same protein · chain C against A, TM-score 0.99
  • Q9BSB4 · AlphaFold monomer V2.0 prediction for autophagy-related protein 101 (Q9BSB4) · a predicted model of the same protein · chain B against A, TM-score 0.95

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