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Reaction centre light harvesting complex 1 from blc. virids

Analyse Reaction centre light harvesting complex 1 from blc. virids in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6ET5
Type
protein
Length
3,491 residues
Chains
54
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Photosynthetic reaction center cytochrome C subunit; Reaction center protein L chain…
UniProt
P07173, P06009, P06010, P06008, P04123, P04124, P04126
Ligands
BCB, NS0, HEM, BPB, UQ9, MQ9, NS5, FE, SO4
Pockets
20 · best druggability 0.89

Structure

electron microscopy · 7 distinct chains · 49% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
CPhotosynthetic reaction center cytochrome C subunitprotein33242% helix, 4% strandP07173
LReaction center protein L chainprotein27366% helix, 4% strandP06009
MReaction center protein M chainprotein32362% helix, 4% strandP06010
HReaction center protein H chainprotein25824% helix, 24% strandP06008
z, F, K, P, S, V, Y, b, e, h, k, n, q, t, w, 3, 6Light-harvesting protein B-1015 alpha chainprotein5853% helix, 0% strandP04123
1, G, N, Q, T, W, Z, c, f, i, l, o, r, u, x, 4, 7Light-harvesting protein B-1015 beta chainprotein5545% helix, 0% strandP04124
2, I, O, R, U, X, a, d, g, j, m, p, s, v, y, 5Light-harvesting protein B-1015 gamma chainprotein2467% helix, 0% strandP04126

Ligands and binding sites

  • BCB · Bacteriochlorophyll B · ligand · 38 copies · chains L, M, z, 1, 2, 3, 4, w, x, y, F, K, G, N, I, P, Q, O, S, T, R, V, W, U, Y, Z, X, b, c, a, e, f, d, h, i, g, k, l, j, n, o, m, q, r, p, t, u, s, H, v, 6, 7, 5
  • NS0 · all-trans-1,2-dihydroneurosporene · ligand · 17 copies · chains z, 1, 2, w, 3, F, K, 6, G, I, P, N, O, S, Q, R, V, T, U, Y, W, X, b, Z, a, e, c, d, h, f, g, k, i, j, n, l, m, q, o, p, t, r, s, u, v, x, y, 4, 5, 7
  • HEM · Protoporphyrin IX containing Fe · ligand · 4 copies · chains C, L, M
  • BPB · Bacteriopheophytin B · ligand · 2 copies · chains L, M
  • UQ9 · Ubiquinone-9 · ligand · 2 copies · chains L, M, 3, 6
  • MQ9 · Menaquinone-9 · ligand · chains L, M, H, z, 3
  • NS5 · 15-cis-1,2-dihydroneurosporene · ligand · chains M, h, k
  • FE · Fe (III) ion · metal · chains L, M
  • SO4 · Sulfate ion · ion · 7 copies · chains L, M, H, k
  • LDA · Lauryl dimethylamine-N-oxide · additive · 2 copies · chains L, M, H

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
110670.890.90114HEM
29990.830.84102NS5
38180.830.8578BCB
46040.810.8668SO4
56010.810.8672empty

Interfaces

189 interfaces between chains.

  • L–M · 4386 Ų buried · 49 hydrogen bonds · protein-protein
  • M–H · 2855 Ų buried · 41 hydrogen bonds · protein-protein
  • C–M · 2725 Ų buried · 28 hydrogen bonds · protein-protein
  • L–H · 1881 Ų buried · 19 hydrogen bonds · protein-protein
  • C–L · 1766 Ų buried · 27 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 covalent, 4 cofactor, 1 modified (covalent ligand, heme attachment, formylation).

Compared structures

  • 6ET5 · Reaction centre light harvesting complex 1 from Blc. virids · the same entry in another collection · chain i against i, TM-score 1.00

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