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MolNFT v1 · #38093 · protein

Structure of porcine electron transfer flavoprotein- ubiquinone oxidoreductase

2GMJ · Electron transfer flavoprotein-ubiquinone oxidoreductase: “Structure of porcine electron transfer flavoprotein- ubiquinone oxidoreductase”. X-ray diffraction, 2 ligands (SF4, FAD), 12 pockets (best druggability 0.86). MolNFT v1…

PDB
2GMJ
Type
protein
Length
1,159 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Electron transfer flavoprotein-ubiquinone oxidoreductase
EC
1.5.5.1
UniProt
P55931
Ligands
SF4, FAD
Pockets
12 · best druggability 0.86

Structure

x-ray diffraction · 2 distinct chains · 26% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AElectron transfer flavoprotein-ubiquinone oxidoreductase (EC 1.5.5.1)protein58127% helix, 22% strandP55931
BElectron transfer flavoprotein-ubiquinone oxidoreductase (EC 1.5.5.1)protein57825% helix, 19% strandP55931

Ligands and binding sites

  • SF4 · Iron/sulfur cluster · ligand · 2 copies · chains A, B
  • FAD · Flavin-adenine dinucleotide · ligand · 2 copies · chains A, B
  • TBU · Tertiary-butyl alcohol · additive · 6 copies · chains A, B

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

Pockets

12 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14150.860.9462FAD
24270.860.9461FAD
38560.830.8582TBU
49580.720.7677empty
51720.530.7917empty

Interfaces

1 interface between chains.

  • A–B · 211 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 2GMJ · Structure of Porcine Electron Transfer Flavoprotein-Ubiqui Oxidoreductase · the same entry in another collection · chain A against A, TM-score 1.00
  • P55931 · AlphaFold monomer V2.0 prediction for electron transfer flavoprotein- ubiquinone… · a predicted model of the same protein · chain A against A, TM-score 1.00

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