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Crystal structure of ESPG3 from the esx-3 type VII secretion system of M. tuberculosis

Analyse Crystal structure of ESPG3 from the esx-3 type VII secretion system of M.… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4W4I
Type
protein
Length
269 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Esx-3 secretion-associated protein ESPG3
UniProt
P9WJC6
Ligands
SO4
Pockets
5 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 33% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEsx-3 secretion-associated protein ESPG3protein26933% helix, 29% strandP9WJC6

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12580.640.8226empty
21660.500.7829empty
3570.340.7719empty
4690.320.7517empty
5500.250.7317empty

Compared structures

  • 4W4I · Crystal structure of EspG3 from the ESX-3 type VII secretion system of M. tuberculosis · the same entry in another collection · chain A against A, TM-score 1.00
  • P9WJC6 · AlphaFold monomer V2.0 prediction for esx-3 secretion-associated protein ESPG3 (P9WJC6) · a predicted model of the same protein · chain A against A, TM-score 0.95

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