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MolNFT v1 · #13054 · protein

Integral membrane peripheral light harvesting complex from rhodopseudomonas acidophila strain 10050

1KZU · Light harvesting protein B-800/850: “Integral membrane peripheral light harvesting complex from rhodopseudomonas acidophila strain 10050”. X-ray diffraction, 2 ligands (BCL, RG1), 6 pockets (best druggability 0.63). MolNFT v1 #13054…

PDB
1KZU
Type
protein
Length
270 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Light harvesting protein B-800/850
UniProt
P26789, P26790
Ligands
BCL, RG1
Pockets
6 · best druggability 0.63

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, GLight harvesting protein B-800/850protein4976% helix, 0% strandP26789
B, E, HLight harvesting protein B-800/850protein4178% helix, 0% strandP26790

Ligands and binding sites

  • BCL · Bacteriochlorophyll A · ligand · 9 copies · chains A, B, D, E, G, H
  • RG1 · Rhodopin b-D-glucoside · ligand · 6 copies · chains A, B, D, E, G, H

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
14560.630.7635RG1
24790.620.7536RG1
32510.530.7524empty
41730.450.7416empty
5940.390.7514empty

Interfaces

9 interfaces between chains.

  • G–H · 681 Ų buried · 6 hydrogen bonds · protein-protein
  • D–E · 679 Ų buried · 6 hydrogen bonds · protein-protein
  • A–B · 677 Ų buried · 6 hydrogen bonds · protein-protein
  • D–G · 490 Ų buried · 4 hydrogen bonds · protein-protein
  • A–D · 488 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 modified (formylation).

Compared structures

  • 1KZU · Integral membrane peripheral light harvesting complex from rhodopseudomonas acidophila… · the same entry in another collection · chain H against H, TM-score 1.00
  • P26789 · AlphaFold monomer V2.0 prediction for light-harvesting protein B-800/850 alpha chain… · a predicted model of the same protein · chain A against A, TM-score 0.89
  • P26790 · AlphaFold monomer V2.0 prediction for light-harvesting protein B-800/850 beta chain… · a predicted model of the same protein · chain B against A, TM-score 0.78

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