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Structure of monomeric photosystem II

Analyse Structure of monomeric photosystem II in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7EDA
Type
protein
Length
2,567 residues
Chains
20
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Photosystem II protein D1; Photosystem II CP47 reaction center protein; Photosystem II…
EC
1.10.3.9
UniProt
P51765, D0VWR1, D0VWR7, D0VWR8, P12238, P12239, P19052, P12240, Q7DGD4, P19054, P12241, P12312, D0VWR2, P12313, P56152, P0A387, D0VWR3, D0VWR4, D0VWR5, P0DM37
Ligands
CLA, BCR, DGD, LHG, LMG, PHO, SQD, PL9, OEX, UNL, BCT, HEM, RRX, HEC, FE2
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 20 distinct chains · 50% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhotosystem II protein D1 (EC 1.10.3.9)protein33457% helix, 4% strandP51765
BPhotosystem II CP47 reaction center proteinprotein50445% helix, 11% strandD0VWR1
CPhotosystem II CP43 reaction center proteinprotein45151% helix, 5% strandD0VWR7
DPhotosystem II D2 protein (EC 1.10.3.9)protein34158% helix, 4% strandD0VWR8
ECytochrome B559 subunit alphaprotein8048% helix, 0% strandP12238
FCytochrome B559 subunit betaprotein3468% helix, 0% strandP12239
HPhotosystem II reaction center protein Hprotein6252% helix, 6% strandP19052
IPhotosystem II reaction center protein Iprotein3266% helix, 0% strandP12240
JPhotosystem II reaction center protein Jprotein3658% helix, 0% strandQ7DGD4
KPhotosystem II reaction center protein Kprotein3759% helix, 0% strandP19054
LPhotosystem II reaction center protein Lprotein3073% helix, 3% strandP12241
MPhotosystem II reaction center protein Mprotein3073% helix, 0% strandP12312
OPhotosystem II manganese-stabilizing polypeptideprotein1922% helix, 48% strandD0VWR2
TPhotosystem II reaction center protein Tprotein2959% helix, 0% strandP12313
UPhotosystem II 12 kda extrinsic proteinprotein8449% helix, 5% strandP56152
VCytochrome C-550protein13540% helix, 7% strandP0A387
YPhotosystem II reaction center protein YCF12protein2770% helix, 0% strandD0VWR3
XPhotosystem II reaction center protein Xprotein3874% helix, 0% strandD0VWR4
ZPhotosystem II reaction center protein Zprotein5768% helix, 0% strandD0VWR5
RPhotosystem II protein Yprotein3476% helix, 0% strandP0DM37

Ligands and binding sites

  • CLA · Chlorophyll A · ligand · 35 copies · chains A, D, L, I, B, H, M, C, K, Y, Z, X
  • BCR · Beta-carotene · ligand · 8 copies · chains A, I, B, M, C, K, Z, D, F, J, Y
  • DGD · Digalactosyl diacyl glycerol (dgdg) · ligand · 4 copies · chains A, C, J, D, V, B, H
  • LHG · 1,2-dipalmitoyl-phosphatidyl-glycerole · ligand · 4 copies · chains A, B, D, L, M, T, C
  • LMG · 1,2-distearoyl-monogalactosyl-diglyceride · ligand · 3 copies · chains A, C, I, B, L, M, D, F, J
  • PHO · Pheophytin A · ligand · 2 copies · chains A, D
  • SQD · 1,2-di-O-acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-sn-glycerol · ligand · 2 copies · chains A, C, D, K, E, F, X, R
  • PL9 · 2,3-dimethyl-5-(3,7,11,15,19,23,27,31,35-nonamethyl-2, 6,10,14,18,22,26,30,34-hexatriacontanonaenyl-2,5-cyclohexadiene-1,4-dione-2,3-dimethyl-5-solanesyl-1,4-benzoquinone · ligand · 2 copies · chains A, D, F, X, L
  • OEX · Ca-MN4-O5 cluster · ligand · chains A, C
  • UNL · Unknown ligand · ligand · chains B
  • BCT · Bicarbonate ion · ligand · chains A, D
  • HEM · Protoporphyrin IX containing Fe · ligand · chains E, F, R
  • RRX · (3R)-beta,beta-caroten-3-ol · ligand · chains H, X
  • HEC · Heme C · ligand · chains C, V
  • FE2 · Fe (II) ion · metal · chains A, D

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
111140.860.8794CLA, BCR
27670.850.8878HEC
35440.810.8747CLA
411610.810.81105CLA, DGD
511290.810.81106CLA, DGD

Interfaces

63 interfaces between chains.

  • A–D · 5421 Ų buried · 83 hydrogen bonds · protein-protein
  • A–C · 3257 Ų buried · 50 hydrogen bonds · protein-protein
  • B–D · 2964 Ų buried · 39 hydrogen bonds · protein-protein
  • B–H · 1870 Ų buried · 31 hydrogen bonds · protein-protein
  • D–E · 1393 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 modified, 2 cofactor, 1 disulfide (heme c attachment, formylation, disulfide, nonstandard).

Compared structures

  • 7EDA · Structure of monomeric photosystem II · the same entry in another collection · chain L against L, TM-score 1.00

Analyse

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