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MolNFT v1 · #102193 · protein

Structure of membrane binding protein pleurotolysin B from pleurotus ostreatus

4OEJ: “Structure of membrane binding protein pleurotolysin B from pleurotus ostreatus”. X-ray diffraction, 1 ligand (CL), 5 pockets (best druggability 0.72). MolNFT v1 #102193 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4OEJ
Type
protein
Length
464 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pleurotolysin B
UniProt
Q5W9E8
Ligands
CL
Pockets
5 · best druggability 0.72

Structure

x-ray diffraction · 1 distinct chain · 24% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APleurotolysin Bprotein46424% helix, 31% strandQ5W9E8

Ligands and binding sites

  • CL · Chloride ion · ion · chains A
  • ACT · Acetate ion · additive · 4 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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17840.720.7756GOL
24060.710.8250ACT
31460.460.7721ACT
41100.410.7629ACT
5790.350.7522empty

Compared structures

  • 4OEJ · Structure of membrane binding protein pleurotolysin B from Pleurotus ostreatus · the same entry in another collection · chain A against A, TM-score 1.00

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