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MolNFT v1 · #189398 · protein

Phycocyanin rod structure of cyanobacterial phycobilisome

7VEB · C-phycocyanin alpha subunit: “Phycocyanin rod structure of cyanobacterial phycobilisome”. Electron microscopy, 1 ligand (CYC), 20 pockets (best druggability 0.88). MolNFT v1 #189398 on GenesisL1: 3D structure, binding sites and…

PDB
7VEB
Type
protein
Length
4,537 residues
Chains
27
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
C-phycocyanin alpha subunit; C-phycocyanin beta subunit; Phycobilisome 8.9 kda linker…
UniProt
P50032, P50033, P50035, P50034, P50040
Ligands
CYC
Pockets
20 · best druggability 0.88

Structure

electron microscopy · 5 distinct chains · 54% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, E, G, I, K, M, O, Q, S, U, WC-phycocyanin alpha subunitprotein16277% helix, 0% strandP50032
B, D, F, H, J, L, N, P, R, T, V, XC-phycocyanin beta subunitprotein17273% helix, 0% strandP50033
YPhycobilisome 8.9 kda linker polypeptide, phycocyanin- associated, rodprotein6218% helix, 26% strandP50035
ZPhycobilisome 32.1 kda linker polypeptide, phycocyanin- associated, rodprotein28241% helix, 7% strandP50034
aPhycobilisome rod-core linker polypeptide CPCG2protein18549% helix, 1% strandP50040

Ligands and binding sites

  • CYC · Phycocyanobilin · ligand · 36 copies · chains A, D, B, Y, E, C, J, Z, G, L, F, H, I, K, M, P, N, Q, O, V, a, S, X, R, T, U, W

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

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110810.880.90111CYC
210430.880.90140empty
35780.870.9271CYC
46540.860.9081CYC
55330.840.9046CYC

Interfaces

97 interfaces between chains.

  • O–P · 1653 Ų buried · 11 hydrogen bonds · protein-protein
  • S–T · 1651 Ų buried · 7 hydrogen bonds · protein-protein
  • K–L · 1648 Ų buried · 12 hydrogen bonds · protein-protein
  • I–J · 1641 Ų buried · 7 hydrogen bonds · protein-protein
  • G–H · 1640 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 modified (nonstandard).

Compared structures

  • 7VEB · Phycocyanin rod structure of cyanobacterial phycobilisome · the same entry in another collection · chain K against K, TM-score 1.00

Analyse

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