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2.20 ångström resolution crystal structure of protein YE0340 of unidentified function from yersinia enterocolitica subsp. enterocolitica 8081]

Analyse 2.20 ångström resolution crystal structure of protein YE0340 of unidentified… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4ZOS
Type
protein
Length
403 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein YE0340 from yersinia enterocolitica subsp. enterocolitica 8081
Ligands
PO4
Pockets
7 · best druggability 0.67

Structure

x-ray diffraction · 4 distinct chains · 44% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein YE0340 from yersinia enterocolitica subsp. enterocolitica 8081protein10547% helix, 36% strand—
BProtein YE0340 from yersinia enterocolitica subsp. enterocolitica 8081protein9742% helix, 39% strand—
CProtein YE0340 from yersinia enterocolitica subsp. enterocolitica 8081protein10346% helix, 37% strand—
DProtein YE0340 from yersinia enterocolitica subsp. enterocolitica 8081protein9841% helix, 40% strand—

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 2 copies · chains B, D

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

7 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14570.670.7949empty
2990.530.8219empty
3780.510.8317PO4
41030.500.8016empty
5960.500.8118PO4

Interfaces

5 interfaces between chains.

  • A–B · 1090 Ų buried · 19 hydrogen bonds · protein-protein
  • C–D · 1088 Ų buried · 18 hydrogen bonds · protein-protein
  • B–D · 208 Ų buried · 1 hydrogen bond · protein-protein
  • A–D · 167 Ų buried · 0 hydrogen bonds · protein-protein
  • A–C · 73 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 4ZOS · 2.20 Angstrom resolution crystal structure of protein YE0340 of unidentified function… · the same entry in another collection · chain A against A, TM-score 1.00

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