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C-Phycocyanin from heterocyst forming filamentous cyanobacterium Nostoc sp. WR13

Analyse C-Phycocyanin from heterocyst forming filamentous cyanobacterium Nostoc sp. WR13 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6HRN
Type
protein
Length
334 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.513
Source
Nostoc sp.
Molecule
Alpha Subunit of Cyanobacterial Phycocyanin protein; Beta Subunit of Cyanobacterial…
Ligands
CYC, PO4, NO3
Pockets
2 · best druggability 0.61

Structure

x-ray diffraction · resolution 1.513 · 2 distinct chains · 77% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAlpha Subunit of Cyanobacterial Phycocyanin proteinprotein16278% helix, 0% strand—
BBeta Subunit of Cyanobacterial Phycocyanin proteinprotein17276% helix, 0% strand—

Ligands and binding sites

  • CYC · Phycocyanobilin · ligand · 3 copies · chains A, B
  • PO4 · Phosphate ion · ion · chains B
  • NO3 · Nitrate ion · ion · chains B
  • PG4 · Tetraethylene glycol · additive · 5 copies · chains A, B
  • PEG · Di(hydroxyethyl)ether · additive · 2 copies · chains A, B
  • PGE · Triethylene glycol · additive · 2 copies · chains B
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · chains 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1950.610.8821CYC
21780.550.8028CYC

Interfaces

1 interface between chains.

  • A–B · 1652 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 cofactor, 1 modified (phycocyanobilin attachment, nonstandard).

Compared structures

  • 6HRN · C-phycocyanin from heterocyst forming filamentous cyanobacterium nostoc sp. WR13 · the same entry in another collection · chain A against A, TM-score 1.00

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