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Structure of a bacterial energy-coupling factor transporter

Analyse Structure of a bacterial energy-coupling factor transporter in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4HZU
Type
protein
Length
961 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Energy-coupling factor transporter ATP-binding protein ecfa 1; Energy-coupling factor…
EC
3.6.3.-
UniProt
Q03PY6, Q03PY5, Q03PY7, Q03NM0
Pockets
11 · best druggability 0.80

Structure

x-ray diffraction · 4 distinct chains · 53% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BEnergy-coupling factor transporter ATP-binding protein ecfa 1 (EC 3.6.3.-)protein28441% helix, 20% strandQ03PY6
AEnergy-coupling factor transporter ATP-binding protein ecfa 2 (EC 3.6.3.-)protein27339% helix, 19% strandQ03PY5
TEnergy-coupling factor transporter transmembrane protein ecftprotein24070% helix, 0% strandQ03PY7
SPredicted membrane proteinprotein16473% helix, 1% strandQ03NM0

Pockets

11 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19490.800.8290empty
29010.770.8078empty
35340.760.8349empty
43130.670.8243empty
51540.600.8326empty

Interfaces

5 interfaces between chains.

  • T–S · 2789 Ų buried · 5 hydrogen bonds · protein-protein
  • B–A · 1516 Ų buried · 12 hydrogen bonds · protein-protein
  • A–T · 1401 Ų buried · 12 hydrogen bonds · protein-protein
  • B–T · 757 Ų buried · 6 hydrogen bonds · protein-protein
  • B–S · 87 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 4HZU · Structure of a bacterial energy-coupling factor transporter · the same entry in another collection · chain B against B, TM-score 1.00
  • Q03PY6 · AlphaFold monomer V2.0 prediction for energy-coupling factor transporter ATP-binding… · a predicted model of the same protein · chain B against A, TM-score 0.98
  • Q03PY5 · AlphaFold monomer V2.0 prediction for energy-coupling factor transporter ATP-binding… · a predicted model of the same protein · chain A against A, TM-score 0.92
  • Q03PY7 · AlphaFold monomer V2.0 prediction for energy-coupling factor transporter transmembrane… · a predicted model of the same protein · chain T against A, TM-score 0.86

Analyse

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