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Rba sphaeroides pufy-ko rc-LH1 monomer

Analyse Rba sphaeroides pufy-ko rc-LH1 monomer in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7VNM
Type
protein
Length
2,112 residues
Chains
30
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Reaction center protein L chain; Reaction center protein M chain; Reaction center protein…
UniProt
Q3J1A5, Q3J1A6, Q3J170, Q3J1A4, Q3J1A3, P13402
Ligands
BCL, SPO, PC1, BPH, U10, CDL, FE2
Pockets
20 · best druggability 0.82

Structure

electron microscopy · 13 distinct chains · 60% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LReaction center protein L chainprotein28162% helix, 4% strandQ3J1A5
MReaction center protein M chainprotein30565% helix, 3% strandQ3J1A6
HReaction center protein H chainprotein24724% helix, 23% strandQ3J170
A, D, F, I, K, O, Q, S, U, W, 9Light-harvesting protein B-875 alpha chainprotein5474% helix, 0% strandQ3J1A4
BLight-harvesting protein B-875 beta chainprotein4571% helix, 0% strandQ3J1A3
E, G, J, N, P, R, TLight-harvesting protein B-875 beta chainprotein4374% helix, 0% strandQ3J1A3
VLight-harvesting protein B-875 beta chainprotein4080% helix, 0% strandQ3J1A3
CLight-harvesting protein B-875 beta chainprotein3884% helix, 0% strandQ3J1A3
7Light-harvesting protein B-875 alpha chainprotein4667% helix, 0% strandQ3J1A4
8, 0Light-harvesting protein B-875 beta chainprotein4473% helix, 0% strandQ3J1A3
XIntrinsic membrane protein pufxprotein5271% helix, 0% strandP13402
1Light-harvesting protein B-875 alpha chainprotein4377% helix, 0% strandQ3J1A4
2Light-harvesting protein B-875 beta chainprotein3284% helix, 0% strandQ3J1A3

Ligands and binding sites

  • BCL · Bacteriochlorophyll A · ligand · 30 copies · chains L, M, A, B, 9, 0, D, E, F, G, I, J, K, N, O, P, Q, R, S, T, U, V, W, C, 7, 8, X, 1, 2
  • SPO · Spheroidene · ligand · 22 copies · chains M, O, Q, A, B, D, 9, 0, E, F, G, I, J, K, N, P, R, S, T, U, V, W, 7, 8, X
  • PC1 · 1,2-diacyl-sn-glycero-3-phosphocholine · ligand · 7 copies · chains L, D, M, H, A, 9, 7, X
  • BPH · Bacteriopheophytin A · ligand · 2 copies · chains L, M
  • U10 · Ubiquinone-10 · ligand · 2 copies · chains L, M, 9
  • CDL · Cardiolipin · ligand · chains L, M, H, I, K
  • FE2 · Fe (II) ion · metal · chains L, M

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
16650.820.8668empty
28750.820.8482BCL
35590.800.8556SPO
48010.790.8280SPO, PC1
55710.790.8466empty

Interfaces

86 interfaces between chains.

  • L–M · 4715 Ų buried · 60 hydrogen bonds · protein-protein
  • M–H · 2915 Ų buried · 34 hydrogen bonds · protein-protein
  • L–H · 1632 Ų buried · 13 hydrogen bonds · protein-protein
  • L–X · 886 Ų buried · 6 hydrogen bonds · protein-protein
  • 7–8 · 820 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 7VNM · Rba sphaeroides PufY-KO RC-LH1 monomer · the same entry in another collection · chain I against I, TM-score 1.00

Analyse

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