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Structure of PCW3 conjugation coupling protein tcpa monomer form with atpgs

Analyse Structure of PCW3 conjugation coupling protein tcpa monomer form with atpgs in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6O1X
Type
protein
Length
702 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA translocase coupling protein
UniProt
Q1PLI0
Ligands
AGS, BGC
Pockets
8 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 35% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA translocase coupling proteinprotein35437% helix, 24% strandQ1PLI0
BDNA translocase coupling proteinprotein34832% helix, 24% strandQ1PLI0

Ligands and binding sites

  • AGS · Phosphothiophosphoric acid-adenylate ester · ligand · chains A
  • BGC · beta-D-glucopyranose · sugar · 2 copies · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

8 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16890.770.8387empty
22660.590.7930empty
31450.560.8223empty
41460.500.7827empty
5840.470.8123empty

Interfaces

1 interface between chains.

  • A–B · 1295 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 6O1X · Structure of pCW3 conjugation coupling protein TcpA monomer form with ATPgS · the same entry in another collection · chain A against A, TM-score 1.00

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