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MolNFT v1 · #115910 · protein

Crystal structure of the cyanobacterial plasma membrane rieske protein PETC3 from synechocystis pcc 6803

5CXM · Cytochrome B6/F complex iron-sulfur subunit: “Crystal structure of the cyanobacterial plasma membrane rieske protein PETC3 from synechocystis pcc 6803”. X-ray diffraction, 3 ligands (FES, NI, SO4), 1 pocket (best druggability 0.52).…

PDB
5CXM
Type
protein
Length
396 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytochrome B6/F complex iron-sulfur subunit
UniProt
P74174
Ligands
FES, NI, SO4
Pockets
1 · best druggability 0.52

Structure

x-ray diffraction · 1 distinct chain · 10% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DCytochrome B6/F complex iron-sulfur subunitprotein9910% helix, 45% strandP74174

Ligands and binding sites

  • FES · Fe2/s2 (inorganic) cluster · ligand · 4 copies · chains A, B, C, D
  • NI · Nickel (II) ion · metal · 4 copies · chains A, B, C, D
  • SO4 · Sulfate ion · ion · chains D

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12980.520.7433empty

Interfaces

3 interfaces between chains.

  • B–C · 195 Ų buried · 1 hydrogen bond · protein-protein
  • C–D · 158 Ų buried · 2 hydrogen bonds · protein-protein
  • A–B · 151 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 5CXM · Crystal structure of the cyanobacterial plasma membrane Rieske protein PetC3 from… · the same entry in another collection · chain A against A, TM-score 1.00

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