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Crystal structure of an oxidized form of yeast iso-1-cytochrome C at pH 8.8

Analyse Crystal structure of an oxidized form of yeast iso-1-cytochrome C at pH 8.8 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4MU8
Type
protein
Length
214 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytochrome C iso-1
UniProt
P00044
Ligands
HEC, SO4
Pockets
3 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BCytochrome C iso-1protein10740% helix, 2% strandP00044

Ligands and binding sites

  • HEC · Heme C · ligand · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 8 copies · chains A, B
  • TBU · Tertiary-butyl alcohol · additive · 3 copies · chains A, B
  • GOL · Glycerol · additive · chains B

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

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12130.790.9334HEC
22200.790.9231HEC
3940.340.7421empty

Interfaces

1 interface between chains.

  • A–B · 285 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 cofactor (heme c attachment).

Compared structures

  • 4MU8 · Crystal structure of an oxidized form of yeast iso-1-cytochrome c at pH 8.8 · the same entry in another collection · chain A against A, TM-score 1.00
  • P00044 · AlphaFold monomer V2.0 prediction for cytochrome C isoform 1 (P00044) · a predicted model of the same protein · chain B against A, TM-score 0.98

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