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MolNFT v1 · #155145 · protein

Crystal structure of ATG18 from saccharomyces cerevisiae

6KYB · Autophagy-related protein 18: “Crystal structure of ATG18 from saccharomyces cerevisiae”. X-ray diffraction, 20 pockets (best druggability 0.80). MolNFT v1 #155145 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6KYB
Type
protein
Length
1,304 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Autophagy-related protein 18
UniProt
P43601
Pockets
20 · best druggability 0.80

Structure

x-ray diffraction · 4 distinct chains · 0% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAutophagy-related protein 18protein3290% helix, 52% strandP43601
BAutophagy-related protein 18protein3300% helix, 55% strandP43601
CAutophagy-related protein 18protein3280% helix, 51% strandP43601
DAutophagy-related protein 18protein3170% helix, 38% strandP43601

Pockets

20 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11520.800.9734empty
26950.800.8457empty
36900.800.8455empty
410640.800.8189empty
57350.790.8358empty

Interfaces

2 interfaces between chains.

  • B–C · 822 Ų buried · 12 hydrogen bonds · protein-protein
  • A–B · 814 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 6KYB · Crystal structure of Atg18 from Saccharomyces cerevisiae · the same entry in another collection · chain D against D, TM-score 1.00
  • P43601 · AlphaFold monomer V2.0 prediction for autophagy-related protein 18 (P43601) · a predicted model of the same protein · chain A against A, TM-score 0.97

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