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Crystal structure of protein with unknown function from DUF364 family (ZP_00559375.1) from desulfitobacterium hafniense dcb-2 at 2.01 a resolution

Analyse Crystal structure of protein with unknown function from DUF364 family… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3L5O
Type
protein
Length
491 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein from DUF364 family
UniProt
B8FUJ5
Ligands
CL
Pockets
6 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 39% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUncharacterized protein from DUF364 familyprotein24738% helix, 22% strandB8FUJ5
BUncharacterized protein from DUF364 familyprotein24441% helix, 23% strandB8FUJ5

Ligands and binding sites

  • CL · Chloride ion · ion · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A, B
  • IMD · Imidazole · additive · 4 copies · chains A, B

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

Pockets

6 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16100.770.8370CL, IMD, EDO
24090.640.7853CL, IMD, EDO
31830.500.7726empty
41470.470.7621empty
51250.430.7618empty

Interfaces

1 interface between chains.

  • A–B · 953 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 12 modified (engineered).

Compared structures

  • 3L5O · Crystal structure of protein with unknown function from DUF364 family (ZP_00559375.1)… · the same entry in another collection · chain A against A, TM-score 1.00

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