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MolNFT v1 · #168374 · protein

Copper-bound E44Q variant of campylobacter jejuni P19

6WED · Uncharacterized protein: “Copper-bound E44Q variant of campylobacter jejuni P19”. X-ray diffraction, 2 ligands (CU, SO4), 1 pocket (best druggability 0.33). MolNFT v1 #168374 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6WED
Type
protein
Length
314 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
A0A0H3PA01
Ligands
CU, SO4
Pockets
1 · best druggability 0.33

Structure

x-ray diffraction · 1 distinct chain · 4% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BUncharacterized proteinprotein1574% helix, 49% strandA0A0H3PA01

Ligands and binding sites

  • CU · Copper (II) ion · metal · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1510.330.7819empty

Interfaces

1 interface between chains.

  • A–B · 1742 Ų buried · 26 hydrogen bonds · protein-protein

Compared structures

  • 6WED · Copper-bound E44Q variant of Campylobacter jejuni P19 · the same entry in another collection · chain A against A, TM-score 1.00

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