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Crystal structure of Cytochrome c Peroxidase with a Proposed Electron Transfer Pathway Excised to Form a Ligand Binding Channel.

Analyse Crystal structure of Cytochrome c Peroxidase with a Proposed Electron Transfer… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1KXM
Type
protein
Length
290 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.74
Source
Saccharomyces cerevisiae
Molecule
Cytochrome c Peroxidase
EC
1.11.1.5
UniProt
P00431
Ligands
HEM, BZI
Pockets
2 · best druggability 0.81

Structure

x-ray diffraction · resolution 1.74 · 1 distinct chain · 51% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACytochrome c Peroxidase (EC 1.11.1.5)protein29051% helix, 6% strandP00431

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · chains A
  • BZI · Benzimidazole · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14640.810.8858HEM, BZI
2950.410.7718empty

Compared structures

  • 1KXM · Crystal structure of cytochrome C peroxidase with a proposed electron transfer pathway… · the same entry in another collection · chain A against A, TM-score 1.00
  • P00431 · AlphaFold monomer V2.0 prediction for cytochrome C peroxidase, mitochondrial (P00431) · a predicted model of the same protein · chain A against A, TM-score 0.99

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