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MolNFT v1 · #112026 · protein

Phycocyanin structure from T. elongatus at 2.5-a from xfel using a viscous delivery medium for serial femtosecond crystallography

4Z8K · C-phycocyanin alpha chain: “Phycocyanin structure from T. elongatus at 2.5-a from xfel using a viscous delivery medium for serial…”. X-ray diffraction, 1 ligand (CYC), 2 pockets (best druggability 0.61). MolNFT v1 #112026 on…

PDB
4Z8K
Type
protein
Length
334 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
C-phycocyanin alpha chain; C-phycocyanin beta chain
UniProt
P50032, P50033
Ligands
CYC
Pockets
2 · best druggability 0.61

Structure

x-ray diffraction · 2 distinct chains · 76% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AC-phycocyanin alpha chainprotein16278% helix, 0% strandP50032
BC-phycocyanin beta chainprotein17275% helix, 0% strandP50033

Ligands and binding sites

  • CYC · Phycocyanobilin · ligand · 3 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1940.610.8722CYC
21880.590.8130CYC

Interfaces

1 interface between chains.

  • A–B · 1624 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

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

Compared structures

  • 4Z8K · Phycocyanin structure from T. elongatus at 2.5-A from XFEL using a viscous delivery… · the same entry in another collection · chain A against A, TM-score 1.00
  • P50033 · AlphaFold monomer V2.0 prediction for C-phycocyanin beta subunit (P50033) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • P50032 · AlphaFold monomer V2.0 prediction for C-phycocyanin alpha subunit (P50032) · a predicted model of the same protein · chain A against A, TM-score 0.99

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