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Photosystem I tetramer

Analyse Photosystem I tetramer in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6TCL
Type
protein
Length
9,058 residues
Chains
48
Method
electron microscopy
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.2
Source
Nostoc sp. PCC 7120
Molecule
Photosystem I P700 chlorophyll a apoprotein A1; Photosystem I P700 chlorophyll a…
EC
1.97.1.12
UniProt
P58576, P58565, P0A410, P58573, P58575, P58564, P58560, P58568, P58583, P58577, Q8YNB0, P58566
Ligands
CLA, BCR, LMG, LHG, AJP, SF4, PQN, CL0, ECH, DGD
Pockets
20 · best druggability 0.78

Structure

electron microscopy · resolution 3.2 · 19 distinct chains · 54% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A1, A2, A, AAPhotosystem I P700 chlorophyll a apoprotein A1 (EC 1.97.1.12)protein74061% helix, 5% strandP58576
B1, B2, B, BBPhotosystem I P700 chlorophyll a apoprotein A2 1 (EC 1.97.1.12)protein73960% helix, 3% strandP58565
C1, C2, C, CCPhotosystem I iron-sulfur center (EC 1.97.1.12)protein8014% helix, 19% strandP0A410
D1, D2, D, DDPhotosystem I reaction center subunit IIprotein13418% helix, 23% strandP58573
E1, E2Photosystem I reaction center subunit IVprotein600% helix, 33% strandP58575
F1, F, FFPhotosystem I reaction center subunit IIIprotein13953% helix, 5% strandP58564
I1, I, IIPhotosystem I reaction center subunit VIIIprotein3184% helix, 0% strandP58560
J1, J2, J, JJPhotosystem I reaction center subunit IXprotein4372% helix, 0% strandP58568
K1Photosystem I reaction center subunit PsaK 1protein7458% helix, 0% strandP58583
L1Photosystem I reaction center subunit XIprotein16653% helix, 3% strandP58577
M1, M2, M, MMPhotosystem I reaction center subunit XIIprotein3184% helix, 0% strandQ8YNB0
X1, X2, X, XXPhotosystem I 4.8 kDa proteinprotein3954% helix, 0% strandP58566
F2Photosystem I reaction center subunit IIIprotein13747% helix, 5% strandP58564
I2Photosystem I reaction center subunit VIIIprotein3379% helix, 0% strandP58560
K2Photosystem I reaction center subunit PsaK 1protein7356% helix, 0% strandP58583
L2Photosystem I reaction center subunit XIprotein16754% helix, 3% strandP58577
E, EEPhotosystem I reaction center subunit IVprotein630% helix, 37% strandP58575
K, KKPhotosystem I reaction center subunit PsaK 1protein6068% helix, 0% strandP58583
L, LLPhotosystem I reaction center subunit XIprotein15460% helix, 3% strandP58577

Ligands and binding sites

  • CLA · Chlorophyll A · ligand · 378 copies · chains A1, B1, F1, J1, K1, L1, I1, BB, M1, L, X1, A2, B2, K2, F2, J2, L2, I2, B, M2, LL, X2, A, F, J, K, I, M, X, AA, FF, JJ, KK, II, MM, XX
  • BCR · Beta-carotene · ligand · 94 copies · chains A1, B1, F1, J1, I1, K1, L1, M1, A2, B2, F2, J2, I2, L2, K2, M2, A, B, K, F, J, I, L, M, AA, BB, KK, FF, JJ, II, LL, MM
  • LMG · 1,2-distearoyl-monogalactosyl-diglyceride · ligand · 30 copies · chains A1, L1, B1, L, I1, M1, K1, BB, A2, L2, B2, LL, I2, M2, K2, B, M, I, II, MM
  • LHG · 1,2-dipalmitoyl-phosphatidyl-glycerole · ligand · 24 copies · chains A1, B1, X1, I1, L1, L, A2, B2, X2, I2, L2, LL, A, B, X, F, AA, BB, XX, FF
  • AJP · Digitonin · ligand · 22 copies · chains A1, L1, BB, A2, I2, M2, LL, L2, B, AA, A, K2, I, L, K, I1, M1, K1, II, KK
  • SF4 · Iron/sulfur cluster · ligand · 12 copies · chains A1, B1, C1, A2, B2, C2, A, B, C, AA, BB, CC
  • PQN · Phylloquinone · ligand · 8 copies · chains A1, J1, B1, A2, J2, B2, A, J, B, AA, JJ, BB
  • CL0 · Chlorophyll A isomer · ligand · 4 copies · chains A1, B1, A2, B2, A, B, AA, BB
  • ECH · beta,beta-caroten-4-one · ligand · 4 copies · chains B1, B2, B, BB
  • DGD · Digalactosyl diacyl glycerol (dgdg) · sugar · 2 copies · chains A2, B, A1, BB

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
19490.780.8070CLA, LMG
211700.780.8087CLA, LMG
37250.770.8265LMG
46680.760.8158LMG
53250.760.8639CLA

Interfaces

122 interfaces between chains.

  • A–B · 3597 Ų buried · 41 hydrogen bonds · protein-protein
  • A1–B1 · 3596 Ų buried · 37 hydrogen bonds · protein-protein
  • AA–BB · 3581 Ų buried · 36 hydrogen bonds · protein-protein
  • A2–B2 · 3522 Ų buried · 35 hydrogen bonds · protein-protein
  • C1–D1 · 1737 Ų buried · 30 hydrogen bonds · protein-protein

Compared structures

  • P58576 · AlphaFold monomer V2.0 prediction for photosystem I P700 chlorophyll a apoprotein A1… · a predicted model of the same protein · chain A1 against A, TM-score 1.00
  • P58565 · AlphaFold monomer V2.0 prediction for photosystem I P700 chlorophyll a apoprotein A2 1… · a predicted model of the same protein · chain B1 against A, TM-score 1.00
  • P58564 · AlphaFold monomer V2.0 prediction for photosystem I reaction center subunit III (P58564) · a predicted model of the same protein · chain F1 against A, TM-score 0.97
  • P58573 · AlphaFold monomer V2.0 prediction for photosystem I reaction center subunit II (P58573) · a predicted model of the same protein · chain D1 against A, TM-score 0.97
  • P58575 · AlphaFold monomer V2.0 prediction for photosystem I reaction center subunit IV (P58575) · a predicted model of the same protein · chain E1 against A, TM-score 0.96
  • P0A410 · AlphaFold monomer V2.0 prediction for photosystem I iron-sulfur center (P0A410) · a predicted model of the same protein · chain C1 against A, TM-score 0.93
  • P58583 · AlphaFold monomer V2.0 prediction for photosystem I reaction center subunit psak 1… · a predicted model of the same protein · chain K1 against A, TM-score 0.92
  • P58577 · AlphaFold monomer V2.0 prediction for photosystem I reaction center subunit XI (P58577) · a predicted model of the same protein · chain L against A, TM-score 0.90
  • P58560 · AlphaFold monomer V2.0 prediction for photosystem I reaction center subunit VIII (P58560) · a predicted model of the same protein · chain I1 against A, TM-score 0.88

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