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Structure of the complex of aquifex aeolicus secyeg and bacillus subtilis seca

Analyse Structure of the complex of aquifex aeolicus secyeg and bacillus subtilis seca in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3DL8
Type
protein
Length
2,558 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein translocase subunit seca; Preprotein translocase subunit secy; Sece…
UniProt
P28366, O66491, O66505
Pockets
20 · best druggability 0.70

Structure

x-ray diffraction · 4 distinct chains · 54% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BProtein translocase subunit secaprotein77351% helix, 8% strandP28366
G, HPreprotein translocase subunit secyprotein40655% helix, 1% strandO66491
C, DSeceprotein3594% helix, 0% strand—
E, FProtein-export membrane protein secgprotein6563% helix, 0% strandO66505

Pockets

20 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110740.700.75113empty
211560.690.75138empty
310140.690.74104empty
49650.680.7595empty
58470.680.76110empty

Interfaces

10 interfaces between chains.

  • A–G · 536 Ų buried · 2 hydrogen bonds · protein-protein
  • B–H · 494 Ų buried · 4 hydrogen bonds · protein-protein
  • A–B · 212 Ų buried · 2 hydrogen bonds · protein-protein
  • H–F · 145 Ų buried · 0 hydrogen bonds · protein-protein
  • G–E · 136 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 3DL8 · Structure of the complex of aquifex aeolicus SecYEG and bacillus subtilis SecA · the same entry in another collection · chain F against F, TM-score 1.00
  • O66491 · AlphaFold monomer V2.0 prediction for protein translocase subunit secy (O66491) · a predicted model of the same protein · chain G against A, TM-score 0.80
  • P28366 · AlphaFold monomer V2.0 prediction for protein translocase subunit seca (P28366) · a predicted model of the same protein · chain A against A, TM-score 0.77
  • O66505 · AlphaFold monomer V2.0 prediction for protein-export membrane protein secg (O66505) · a predicted model of the same protein · chain E against A, TM-score 0.63

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