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Crystal structure of an uncharacterized protein (O28723_ARCFU) from archaeoglobus fulgidus

Analyse Crystal structure of an uncharacterized protein (O28723_ARCFU) from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3BPD
Type
protein
Length
1,273 residues
Chains
14
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
O28723
Ligands
MG
Pockets
19 · best druggability 0.58

Structure

x-ray diffraction · 4 distinct chains · 20% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, KUncharacterized proteinprotein9120% helix, 51% strandO28723
B, C, E, G, H, J, L, MUncharacterized proteinprotein9121% helix, 47% strandO28723
FUncharacterized proteinprotein9221% helix, 50% strandO28723
I, NUncharacterized proteinprotein9020% helix, 48% strandO28723

Ligands and binding sites

  • MG · Magnesium ion · metal · 27 copies · chains A, H, B, I, C, J, D, K, E, L, F, M, G, N

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

Pockets

19 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1960.580.8621empty
2600.520.8715empty
3520.510.8819empty
4600.500.8618empty
5710.480.8320empty

Interfaces

28 interfaces between chains.

  • A–G · 851 Ų buried · 13 hydrogen bonds · protein-protein
  • C–D · 838 Ų buried · 11 hydrogen bonds · protein-protein
  • J–K · 829 Ų buried · 12 hydrogen bonds · protein-protein
  • H–I · 829 Ų buried · 11 hydrogen bonds · protein-protein
  • H–N · 826 Ų buried · 10 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 14 modified (engineered).

Compared structures

  • 3BPD · Crystal structure of an uncharacterized protein (O28723_ARCFU) from Archaeoglobus fulgidus · the same entry in another collection · chain A against A, TM-score 1.00

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