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Fusion protein of heme oxygenase-1 and NADPH-cytochrome P450 reductase (13aa)

Analyse Fusion protein of heme oxygenase-1 and NADPH-cytochrome P450 reductase (13aa) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6J79
Type
protein
Length
1,629 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.331
Source
Rattus norvegicus
Molecule
Heme oxygenase 1,NADPH--cytochrome P450 reductase
EC
1.14.14.18, 1.6.2.4
UniProt
P06762, P00388
Ligands
FAD, FMN, HEM
Pockets
20 · best druggability 0.77

Structure

x-ray diffraction · resolution 3.331 · 2 distinct chains · 46% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHeme oxygenase 1,NADPH--cytochrome P450 reductase (EC 1.14.14.18, 1.6.2.4)protein81646% helix, 16% strandP06762, P00388
BHeme oxygenase 1,NADPH--cytochrome P450 reductase (EC 1.14.14.18, 1.6.2.4)protein81347% helix, 15% strandP06762, P00388

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · 2 copies · chains A, B
  • FMN · Flavin mononucleotide · ligand · 2 copies · chains A, B
  • HEM · Protoporphyrin IX containing Fe · ligand · 2 copies · chains A, B

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

Pockets

20 pockets found on a 1 Å grid, 13 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14990.770.8445HEM
24590.760.8447HEM
38130.740.7972empty
46740.730.8099FAD
55870.730.8154empty

Interfaces

1 interface between chains.

  • A–B · 1656 Ų buried · 32 hydrogen bonds · protein-protein

Compared structures

  • 6J79 · Fusion protein of heme oxygenase-1 and NADPH-cytochrome P450 reductase (13AA) · the same entry in another collection · chain A against A, TM-score 1.00
  • P00388 · AlphaFold monomer V2.0 prediction for NADPH--cytochrome P450 reductase (P00388) · a predicted model of the same protein · chain A against A, TM-score 0.60
  • P06762 · AlphaFold monomer V2.0 prediction for heme oxygenase 1 (P06762) · a predicted model of the same protein · chain B against A, TM-score 0.28

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