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R2F from corynebacterium ammoniagenes in its oxidised, fe containing, form

Analyse R2F from corynebacterium ammoniagenes in its oxidised, fe containing, form in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1KGN
Type
protein
Length
1,184 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribonucleotide reductase protein R2F
UniProt
O69274
Ligands
FE
Pockets
9 · best druggability 0.56

Structure

x-ray diffraction · 1 distinct chain · 78% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DRibonucleotide reductase protein R2Fprotein29678% helix, 0% strandO69274

Ligands and binding sites

  • FE · Fe (III) ion · metal · 8 copies · chains A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13270.560.7552empty
23460.550.7446empty
31110.540.8322empty
41020.370.7526empty
5630.340.7715empty

Interfaces

3 interfaces between chains.

  • A–B · 2749 Ų buried · 27 hydrogen bonds · protein-protein
  • C–D · 2730 Ų buried · 26 hydrogen bonds · protein-protein
  • A–D · 251 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 1KGN · R2F from Corynebacterium Ammoniagenes in its oxidised, Fe containing, form · the same entry in another collection · chain A against A, TM-score 1.00

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