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Crystal structure of RC-LH1 core complex from Rhodopseudomonas palustris

Analyse Crystal structure of RC-LH1 core complex from Rhodopseudomonas palustris in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1PYH
Type
protein
Length
1,690 residues
Chains
34
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
4.8
Source
Rhodopseudomonas palustris
Molecule
Reaction center protein L chain; Reaction center protein M chain; Reaction center protein…
Ligands
BCL, BPH, FE
Pockets
12 · best druggability 0.84

Structure

x-ray diffraction · resolution 4.8 · 5 distinct chains · 56% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AReaction center protein L chainprotein28164% helix, 4% strand—
BReaction center protein M chainprotein30266% helix, 4% strand—
CReaction center protein H chainprotein24126% helix, 24% strand—
D, F, H, J, L, N, P, R, T, V, X, Z, 1, 3, 5, 7Light-harvesting protein B-800/850, alpha chainprotein2685% helix, 0% strand—
E, G, I, K, M, O, Q, S, U, W, Y, 2, 4, 6, 8Light-harvesting protein B-800/850, beta chainprotein3093% helix, 0% strand—

Ligands and binding sites

  • BCL · Bacteriochlorophyll A · ligand · 34 copies · chains A, B, D, E, F, G, H, I, J, K, L, M, N, O, P, Q, R, S, T, U, V, W, X, Y, 1, 2, 3, 4, 5, 6, 7, 8
  • BPH · Bacteriopheophytin A · ligand · 2 copies · chains A, B
  • FE · Fe (III) ion · metal

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

Pockets

12 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19020.840.86157empty
23290.770.8859empty
32280.690.8637FE
4860.560.8630empty
53250.560.7547empty

Interfaces

23 interfaces between chains.

  • A–B · 1677 Ų buried · 9 hydrogen bonds · protein-protein
  • B–C · 947 Ų buried · 6 hydrogen bonds · protein-protein
  • A–C · 711 Ų buried · 9 hydrogen bonds · protein-protein
  • A–7 · 201 Ų buried · 0 hydrogen bonds · protein-protein
  • C–F · 116 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 1PYH · Crystal structure of rc-LH1 core complex from rhodopseudomonas palustris · the same entry in another collection · chain 2 against 2, TM-score 1.00

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