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MolNFT v1 · #38750 · protein

Avian mitochondrial respiratory complex II at 1.8 ångström resolution

2H88 · Succinate dehydrogenase flavoprotein subunit: “Avian mitochondrial respiratory complex II at 1.8 ångström resolution”. X-ray diffraction, 10 ligands (FAD, TEO, FES), 20 pockets (best druggability 0.86). MolNFT v1 #38750 on…

PDB
2H88
Type
protein
Length
2,182 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Succinate dehydrogenase flavoprotein subunit; Succinate dehydrogenase ip subunit…
EC
1.3.5.1
UniProt
Q9YHT1, Q9YHT2, Q5ZIS0
Ligands
FAD, TEO, FES, SF4, F3S, BHG, HEM, K, UNL, AZI
Pockets
20 · best druggability 0.86

Structure

x-ray diffraction · 4 distinct chains · 44% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, NSuccinate dehydrogenase flavoprotein subunit (EC 1.3.5.1)protein61235% helix, 23% strandQ9YHT1
B, OSuccinate dehydrogenase ip subunit (EC 1.3.5.1)protein23933% helix, 15% strandQ9YHT2
C, PSuccinate dehydrogenase cytochrome B, large subunit (EC 1.3.5.1)protein13975% helix, 1% strand—
D, QSuccinate dehydrogenase cytochrome B, small subunit (EC 1.3.5.1)protein10187% helix, 0% strandQ5ZIS0

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · 2 copies · chains A, B, N, O
  • TEO · Malate like intermediate · ligand · 2 copies · chains A, N
  • FES · Fe2/s2 (inorganic) cluster · ligand · 2 copies · chains B, O
  • SF4 · Iron/sulfur cluster · ligand · 2 copies · chains B, O
  • F3S · FE3-S4 cluster · ligand · 2 copies · chains B, O
  • BHG · hexyl beta-D-galactopyranoside · ligand · 2 copies · chains B, C, P, O
  • HEM · Protoporphyrin IX containing Fe · ligand · 2 copies · chains B, C, D, O, P, Q
  • K · Potassium ion · metal · 4 copies · chains A, B, N, O
  • UNL · Unknown ligand · ion · 64 copies · chains A, B, C, D, N, O, P, Q
  • AZI · Azide ion · ion · 2 copies · chains A, B, N, O
  • GOL · Glycerol · additive · 2 copies · chains B, C, O, P

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

Pockets

20 pockets found on a 1 Å grid, 19 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13280.860.9660FAD, TEO
23180.860.9656FAD, TEO
311150.840.8492UNL, HEM
411880.830.8498UNL, HEM
54570.790.8746empty

Interfaces

15 interfaces between chains.

  • N–O · 2716 Ų buried · 51 hydrogen bonds · protein-protein
  • A–B · 2711 Ų buried · 51 hydrogen bonds · protein-protein
  • O–P · 1822 Ų buried · 17 hydrogen bonds · protein-protein
  • B–C · 1822 Ų buried · 17 hydrogen bonds · protein-protein
  • C–D · 1366 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 cofactor (flavinylation).

Compared structures

  • 2H88 · Avian Mitochondrial Respiratory Complex II at 1.8 Angstrom Resolution · the same entry in another collection · chain Q against Q, TM-score 1.00
  • Q9YHT1 · AlphaFold monomer V2.0 prediction for succinate dehydrogenase [ubiquinone] flavoprotein… · a predicted model of the same protein · chain A against A, TM-score 1.00
  • Q9YHT2 · AlphaFold monomer V2.0 prediction for succinate dehydrogenase [ubiquinone] iron-sulfur… · a predicted model of the same protein · chain B against A, TM-score 1.00
  • Q5ZIS0 · AlphaFold monomer V2.0 prediction for succinate dehydrogenase [ubiquinone] cytochrome B… · a predicted model of the same protein · chain D against A, TM-score 0.99

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