GL1X · GenesisL1 explorer

MolNFT v1 · #51099 · protein

X-ray high resolution structure of the photosynthetic reaction center from rb. sphaeroides at pH 10 in the neutral state

2UXJ · Reaction center protein H chain: “X-ray high resolution structure of the photosynthetic reaction center from rb. sphaeroides at pH 10 in the…”. X-ray diffraction, 9 ligands (BCL, BPH, HTO), 12 pockets (best druggability 0.83).…

PDB
2UXJ
Type
protein
Length
823 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Reaction center protein H chain; Reaction center protein L chain; Reaction center protein…
UniProt
P0C0Y7, P0C0Y8, P0C0Y9
Ligands
BCL, BPH, HTO, UQ2, U10, SPO, CDL, FE, PO4
Pockets
12 · best druggability 0.83

Structure

x-ray diffraction · 3 distinct chains · 52% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HReaction center protein H chainprotein24025% helix, 24% strandP0C0Y7
LReaction center protein L chainprotein28163% helix, 4% strandP0C0Y8
MReaction center protein M chainprotein30265% helix, 4% strandP0C0Y9

Ligands and binding sites

  • BCL · Bacteriochlorophyll A · ligand · 4 copies · chains L, M
  • BPH · Bacteriopheophytin A · ligand · 2 copies · chains L, M
  • HTO · Heptane-1,2,3-triol · ligand · 2 copies · chains L
  • UQ2 · Ubiquinone-2 · ligand · chains L, M
  • U10 · Ubiquinone-10 · ligand · chains L, M
  • SPO · Spheroidene · ligand · chains M
  • CDL · Cardiolipin · ligand · chains H, L, M
  • FE · Fe (III) ion · metal · chains L, M
  • PO4 · Phosphate ion · ion · chains L
  • LDA · Lauryl dimethylamine-N-oxide · additive · 9 copies · chains L, H, M
  • GOL · Glycerol · additive · 6 copies · chains H, L

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18770.830.8484BCL
21190.770.9634empty
3630.690.9517empty
41370.680.8821U10
51510.630.8530UQ2

Interfaces

3 interfaces between chains.

  • L–M · 4507 Ų buried · 67 hydrogen bonds · protein-protein
  • H–M · 2836 Ų buried · 38 hydrogen bonds · protein-protein
  • H–L · 1619 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 2UXJ · X-ray high resolution structure of the photosynthetic reaction center from Rb.… · the same entry in another collection · chain L against L, TM-score 1.00

Analyse

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.