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Crystal structure of photosystem II

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

PDB
1IZL
Type
protein
Length
4,297 residues
Chains
28
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Photosystem II: subunit psba; Photosystem II: subunit psbb; Photosystem II: subunit psbc…
UniProt
P51765, Q9F1K9, P56150
Ligands
CLA, PHO, HEM, PLA, BCR, MN, FE
Pockets
20 · best druggability 0.85

Structure

x-ray diffraction · 22 distinct chains · 22% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, JPhotosystem II: subunit psbaprotein29926% helix, 0% strandP51765
BPhotosystem II: subunit psbbprotein42726% helix, 0% strand—
CPhotosystem II: subunit psbcprotein34937% helix, 0% strand—
D, NPhotosystem II: subunit psbdprotein27729% helix, 0% strand—
EPhotosystem II: subunit psbeprotein3523% helix, 0% strand—
FPhotosystem II: subunit psbfprotein3037% helix, 0% strand—
G, RPhotosystem II: subunit psbgprotein2200% helix, 0% strand—
HPhotosystem II: subunit psbhprotein3342% helix, 0% strand—
IPhotosystem II: subunit psbiprotein2642% helix, 0% strand—
K, WPhotosystem II: subunit psbkprotein270% helix, 0% strandQ9F1K9
OPhotosystem II: subunit psboprotein2050% helix, 0% strand—
UPhotosystem II: subunit psbuprotein977% helix, 0% strand—
VPhotosystem II: subunit psbvprotein12922% helix, 0% strandP56150
X, T, 1Photosystem II: subunit psbxprotein250% helix, 0% strand—
LPhotosystem II: subunit psbbprotein42426% helix, 0% strand—
MPhotosystem II: subunit psbcprotein34732% helix, 0% strand—
PPhotosystem II: subunit psbeprotein1747% helix, 0% strand—
QPhotosystem II: subunit psbfprotein2627% helix, 0% strand—
SPhotosystem II: subunit psbhprotein3231% helix, 0% strand—
YPhotosystem II: subunit psboprotein1920% helix, 0% strand—
ZPhotosystem II: subunit psbuprotein928% helix, 0% strand—
0Photosystem II: subunit psbvprotein11520% helix, 0% strandP56150

Ligands and binding sites

  • CLA · Chlorophyll A · ligand · 72 copies · chains A, D, B, G, C, K, H, J, L, R, N, M, W
  • PHO · Pheophytin A · ligand · 4 copies · chains A, D, J, N
  • HEM · Protoporphyrin IX containing Fe · ligand · 4 copies · chains E, X, V, P, 1, 0
  • PLA · 2-[(3-hydroxy-2-methyl-5-phosphonooxymethyl-pyridin-4-ylmethyl)-amino]-2-methyl-succinic acid · ligand · 2 copies · chains D, N
  • BCR · Beta-carotene · ligand · 2 copies · chains C, D
  • MN · Manganese (II) ion · metal · 8 copies · chains A, J
  • FE · Fe (III) ion · metal · 2 copies · chains D, N

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
19510.850.86162MN
27710.830.87122MN
39930.790.81103empty
48270.770.81116empty
54880.740.8396empty

Interfaces

74 interfaces between chains.

  • J–N · 2043 Ų buried · 16 hydrogen bonds · protein-protein
  • A–D · 2000 Ų buried · 17 hydrogen bonds · protein-protein
  • A–C · 1309 Ų buried · 9 hydrogen bonds · protein-protein
  • J–M · 1275 Ų buried · 9 hydrogen bonds · protein-protein
  • C–O · 697 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 16 covalent (covalent ligand).

Compared structures

  • 1IZL · Crystal Structure of Photosystem II · the same entry in another collection · chain O against O, TM-score 1.00

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