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Cryo-EM structure of the bacteria-killing type IV secretion system core complex from Xanthomonas citri

Analyse Cryo-EM structure of the bacteria-killing type IV secretion system core complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6GYB
Type
protein
Length
7,546 residues
Chains
42
Method
electron microscopy
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.28
Source
Xanthomonas axonopodis pv. citri (strain 306)
Molecule
VirB7; VirB9 protein; VirB10 protein
UniProt
Q8PJB3, Q8PJB5, Q8PJB6
Pockets
20 · best druggability 0.77

Structure

electron microscopy · resolution 3.28 · 3 distinct chains · 16% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
a, d, g, j, m, p, s, A, D, G, J, M, P, SVirB7protein11122% helix, 26% strandQ8PJB3
b, e, h, k, n, q, t, B, E, H, K, N, Q, TVirB9 proteinprotein2236% helix, 43% strandQ8PJB5
c, f, i, l, o, r, u, C, F, I, L, O, R, UVirB10 proteinprotein20524% helix, 30% strandQ8PJB6

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11270.770.9534empty
21190.770.9636empty
31090.770.9637empty
41210.760.9638empty
51140.760.9636empty

Interfaces

140 interfaces between chains.

  • i–l · 2377 Ų buried · 25 hydrogen bonds · protein-protein
  • l–o · 2376 Ų buried · 26 hydrogen bonds · protein-protein
  • I–L · 2376 Ų buried · 25 hydrogen bonds · protein-protein
  • o–r · 2375 Ų buried · 25 hydrogen bonds · protein-protein
  • O–R · 2374 Ų buried · 26 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 14 disulfide (disulfide).

Compared structures

  • 6GYB · Cryo-EM structure of the bacteria-killing type IV secretion system core complex from… · the same entry in another collection · chain B against B, TM-score 1.00

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