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Cryo-EM structure of enteropathogenic escherichia COLI type III secretion system espa filament

Analyse Cryo-EM structure of enteropathogenic escherichia COLI type III secretion… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7KHW
Type
protein
Length
8,700 residues
Chains
50
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Translocon espa
UniProt
B7UM94
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 1 distinct chain · 60% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, G, H, I, J, K, L, M, N, O, P, Q, R, S, T, U, V, W, X, Y, Z, a, b, c, d, e, f, g, h, i, j, k, l, m, n, o, p, q, r, s, t, u, v, w, xTranslocon espaprotein17460% helix, 0% strandB7UM94

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111270.870.88132empty
210560.870.88132empty
311420.870.88132empty
410570.860.87126empty
510300.860.87129empty

Interfaces

217 interfaces between chains.

  • N–O · 1709 Ų buried · 9 hydrogen bonds · protein-protein
  • h–i · 1708 Ų buried · 9 hydrogen bonds · protein-protein
  • P–Q · 1706 Ų buried · 9 hydrogen bonds · protein-protein
  • r–s · 1705 Ų buried · 9 hydrogen bonds · protein-protein
  • E–F · 1705 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 7KHW · Cryo-EM structure of enteropathogenic Escherichia coli type III secretion system EspA… · the same entry in another collection · chain j against j, TM-score 1.00

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