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MolNFT v1 · #31624 · protein

Crystal structure of the protein-protein complex between F82S cytochrome C and cytochrome C peroxidase

2B10 · Cytochrome C peroxidase, mitochondrial: “Crystal structure of the protein-protein complex between F82S cytochrome C and cytochrome C peroxidase”. X-ray diffraction, 2 ligands (ZNH, HEM), 9 pockets (best druggability 0.85). MolNFT v1…

PDB
2B10
Type
protein
Length
804 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytochrome C peroxidase, mitochondrial; Cytochrome C iso-1
EC
1.11.1.5
UniProt
P00431, P00044
Ligands
ZNH, HEM
Pockets
9 · best druggability 0.85

Structure

x-ray diffraction · 2 distinct chains · 47% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CCytochrome C peroxidase, mitochondrial (EC 1.11.1.5)protein29450% helix, 6% strandP00431
B, DCytochrome C iso-1protein10837% helix, 2% strandP00044

Ligands and binding sites

  • ZNH · Protoporphyrin IX containing Zn · ligand · 2 copies · chains A, C
  • HEM · Protoporphyrin IX containing Fe · ligand · 2 copies · chains A, B, C, D

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

Pockets

9 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19930.850.8698empty
23970.810.8947ZNH
33970.800.8944ZNH
43650.790.8855HEM
54130.780.8758HEM

Interfaces

6 interfaces between chains.

  • A–B · 738 Ų buried · 3 hydrogen bonds · protein-protein
  • C–D · 701 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 442 Ų buried · 3 hydrogen bonds · protein-protein
  • A–D · 328 Ų buried · 2 hydrogen bonds · protein-protein
  • B–C · 187 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 2B10 · Crystal Structure of the Protein-Protein Complex between F82S cytochrome c and cytochrome… · the same entry in another collection · chain D against D, 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 1.00
  • P00044 · AlphaFold monomer V2.0 prediction for cytochrome C isoform 1 (P00044) · a predicted model of the same protein · chain D against A, TM-score 0.98

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