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The crystal structure of a conserved domain from a protein of geobacter sulfurreducens pca

Analyse The crystal structure of a conserved domain from a protein of geobacter… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3E0Y
Type
protein
Length
307 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Conserved domain protein
UniProt
Q74E48
Ligands
NA
Pockets
4 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 38% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AConserved domain proteinprotein15538% helix, 28% strandQ74E48
BConserved domain proteinprotein15238% helix, 27% strandQ74E48

Ligands and binding sites

  • NA · Sodium ion · metal · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1590.700.9619empty
2670.680.9413empty
32220.560.7833empty
41420.460.7724empty

Interfaces

1 interface between chains.

  • A–B · 1189 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 modified (engineered).

Compared structures

  • 3E0Y · The crystal structure of a conserved domain from a protein of Geobacter sulfurreducens PCA · the same entry in another collection · chain A against A, TM-score 1.00

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