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Photosynthetic reaction center from rhodobacter sphaeroides

Analyse Photosynthetic reaction center from rhodobacter sphaeroides in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1Z9J
Type
protein
Length
821 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Reaction center protein L chain; Reaction center protein M chain; Reaction center protein…
UniProt
P0C0Y8, P0C0Y9, P0C0Y7
Ligands
BCL, BPH, U10, FE, MN
Pockets
11 · best druggability 0.81

Structure

x-ray diffraction · 3 distinct chains · 48% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AReaction center protein L chainprotein28160% helix, 4% strandP0C0Y8
BReaction center protein M chainprotein30257% helix, 5% strandP0C0Y9
CReaction center protein H chainprotein23824% helix, 21% strandP0C0Y7

Ligands and binding sites

  • BCL · Bacteriochlorophyll A · ligand · 4 copies · chains A, B
  • BPH · Bacteriopheophytin A · ligand · 2 copies · chains A, B
  • U10 · Ubiquinone-10 · ligand · 2 copies · chains A, B
  • FE · Fe (III) ion · metal · chains A, B
  • MN · Manganese (II) ion · metal · chains B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110280.810.8274BCL
22010.750.9042U10
3720.720.9730empty
41520.610.8432empty
51350.570.8221empty

Interfaces

3 interfaces between chains.

  • A–B · 4567 Ų buried · 67 hydrogen bonds · protein-protein
  • B–C · 2856 Ų buried · 38 hydrogen bonds · protein-protein
  • A–C · 1580 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 1Z9J · Photosynthetic Reaction Center from Rhodobacter sphaeroides · the same entry in another collection · chain A against A, TM-score 1.00
  • P0C0Y8 · AlphaFold monomer V2.0 prediction for reaction center protein L chain (P0C0Y8) · a predicted model of the same protein · chain A against A, TM-score 0.99
  • P0C0Y9 · AlphaFold monomer V2.0 prediction for reaction center protein M chain (P0C0Y9) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • P0C0Y7 · AlphaFold monomer V2.0 prediction for reaction center protein H chain (P0C0Y7) · a predicted model of the same protein · chain C against A, TM-score 0.98

Analyse

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