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Structure of Ferric uptake regulator from Pseudomonas aeruginosa with manganese.

Analyse Structure of Ferric uptake regulator from Pseudomonas aeruginosa with manganese. in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6H1C
Type
protein
Length
266 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.34
Source
Pseudomonas aeruginosa PAO1
Molecule
Ferric uptake regulation protein
UniProt
Q03456
Ligands
ZN, MN
Pockets
2 · best druggability 0.67

Structure

x-ray diffraction · resolution 2.34 · 2 distinct chains · 42% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFerric uptake regulation proteinprotein13241% helix, 17% strandQ03456
BFerric uptake regulation proteinprotein13443% helix, 16% strandQ03456

Ligands and binding sites

  • ZN · Zinc ion · metal · 12 copies · chains A, B
  • MN · Manganese (II) ion · metal · 11 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16150.670.7768ZN
21210.420.7624ZN

Interfaces

1 interface between chains.

  • A–B · 397 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 6H1C · Structure of ferric uptake regulator from pseudomonas aeruginosa with manganese. · the same entry in another collection · chain A against A, TM-score 1.00
  • Q03456 · AlphaFold monomer V2.0 prediction for ferric uptake regulation protein (Q03456) · a predicted model of the same protein · chain B against A, TM-score 0.78

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