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Structural insights into a dimeric PSB27-photosystem II complex from a cyanobacterium thermosynechococcus vulcanus

Analyse Structural insights into a dimeric PSB27-photosystem II complex from a… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7CZL
Type
protein
Length
4,304 residues
Chains
32
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, P19054, P12241, P12312, P12313, D0VWR5, D0VWR3, D0VWR4
Ligands
CLA, BCR, MGE, DGD, SQD, PHO, PQ9, LHG, BCT, HEM, CA, FE2, CL
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 19 distinct chains · 57% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhotosystem II protein D1 (EC 1.10.3.9)protein32457% helix, 3% strandP51765
B, bPhotosystem II CP47 reaction center proteinprotein48448% helix, 8% strandD0VWR1
C, cPhotosystem II CP43 reaction center proteinprotein44654% helix, 2% strandD0VWR7
D, dPhotosystem II D2 protein (EC 1.10.3.9)protein33956% helix, 0% strandD0VWR8
E, eCytochrome B559 subunit alphaprotein6552% helix, 0% strandP12238
FCytochrome B559 subunit betaprotein3171% helix, 0% strandP12239
H, hPhotosystem II reaction center protein Hprotein6244% helix, 2% strandP19052
I, iPhotosystem II reaction center protein Iprotein3468% helix, 0% strandP12240
KPhotosystem II reaction center protein Kprotein3757% helix, 0% strandP19054
L, lPhotosystem II reaction center protein Lprotein3762% helix, 3% strandP12241
M, mPhotosystem II reaction center protein Mprotein3376% helix, 0% strandP12312
T, tPhotosystem II reaction center protein Tprotein3070% helix, 0% strandP12313
Z, zPhotosystem II reaction center protein Zprotein6287% helix, 0% strandD0VWR5
aPhotosystem II protein D1 (EC 1.10.3.9)protein32258% helix, 2% strandP51765
fCytochrome B559 subunit betaprotein2886% helix, 0% strandP12239
kPhotosystem II reaction center protein Kprotein3462% helix, 0% strandP19054
Y, yPhotosystem II reaction center protein YCF12protein2972% helix, 0% strandD0VWR3
n, NPSB27protein10869% helix, 0% strand—
X, xPhotosystem II reaction center protein Xprotein3586% helix, 0% strandD0VWR4

Ligands and binding sites

  • CLA · Chlorophyll A · ligand · 70 copies · chains A, D, T, L, I, B, H, M, C, K, Z, Y, X, a, d, t, l, i, b, h, m, c, k, x, z, y
  • BCR · Beta-carotene · ligand · 22 copies · chains A, I, B, M, t, C, K, Z, D, F, H, T, b, a, i, m, c, k, z, d, f, h, x, y, Y
  • MGE · (1S)-2-(alpha-L-allopyranosyloxy)-1-[(tridecanoyloxy) methyl]ethyl palmitate · ligand · 14 copies · chains A, B, D, L, M, C, I, F, T, b, m, a, c, i, d, f, l, t
  • DGD · Digalactosyl diacyl glycerol (dgdg) · ligand · 8 copies · chains A, C, B, D, H, a, c, d, b, h
  • SQD · 1,2-di-O-acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-sn-glycerol · ligand · 6 copies · chains A, T, b, C, D, K, L, M, l, B, H, a, t, c, d, k, m
  • PHO · Pheophytin A · ligand · 4 copies · chains A, D, a, d
  • PQ9 · 5-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl]-2,3-dimethylbenzo-1,4-quinone · ligand · 4 copies · chains A, D, F, L, T, a, d, l, t
  • LHG · 1,2-dipalmitoyl-phosphatidyl-glycerole · ligand · 2 copies · chains A, C, D, a, c, d
  • BCT · Bicarbonate ion · ligand · 2 copies · chains A, D, a, d
  • HEM · Protoporphyrin IX containing Fe · ligand · 2 copies · chains E, F, e, f
  • CA · Calcium ion · metal · 2 copies · chains C, c
  • FE2 · Fe (II) ion · metal · 2 copies · chains A, D, a, d
  • CL · Chloride ion · ion · 2 copies · chains n, N
  • LMT · Dodecyl-beta-D-maltoside · additive · 6 copies · chains A, b, B, a, t, M, T, 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
18050.850.8777CLA, BCR
29600.830.8468BCR, CLA
39060.830.85111DGD
411400.830.84115empty
510960.830.84115empty

Interfaces

81 interfaces between chains.

  • a–d · 5152 Ų buried · 45 hydrogen bonds · protein-protein
  • A–D · 4987 Ų buried · 43 hydrogen bonds · protein-protein
  • A–C · 2545 Ų buried · 20 hydrogen bonds · protein-protein
  • B–D · 2521 Ų buried · 25 hydrogen bonds · protein-protein
  • b–d · 2519 Ų buried · 21 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 15 covalent (covalent ligand, additive adduct).

Compared structures

  • 7CZL · Structural insights into a dimeric Psb27-photosystem II complex from a cyanobacterium… · the same entry in another collection · chain I against I, TM-score 1.00

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