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MolNFT v1 · #104320 · protein

Light harvesting protein phycocyanin in high resolution using a femtosecond X-ray laser

4Q70 · C-phycocyanin alpha chain: “Light harvesting protein phycocyanin in high resolution using a femtosecond X-ray laser”. X-ray diffraction, 1 ligand (CYC), 6 pockets (best druggability 0.65). MolNFT v1 #104320 on GenesisL1: 3D…

PDB
4Q70
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
6 · best druggability 0.65

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
AC-phycocyanin alpha chainprotein16278% helix, 0% strandP50032
BC-phycocyanin beta chainprotein17277% 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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11150.650.8821CYC
22250.610.8033CYC
34340.580.7437empty
41420.410.7519empty
5590.390.8016empty

Interfaces

1 interface between chains.

  • A–B · 220 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

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

Compared structures

  • 4Q70 · Light Harvesting Protein Phycocyanin in high resolution using a femtosecond X-Ray laser · the same entry in another collection · chain A against A, TM-score 1.00
  • 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 0.98
  • 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 0.97

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