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Crystal structure of porcine mitochondrial respiratory complex II bound with oxaloacetate and pentachlorophenol

Analyse Crystal structure of porcine mitochondrial respiratory complex II bound with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3SFD
Type
protein
Length
1,092 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial; Succinate…
EC
1.3.5.1
UniProt
Q0QF01, Q007T0, D0VWV4, A5GZW8
Ligands
FAD, OAA, FES, SF4, F3S, HEM, PCI
Pockets
15 · best druggability 0.86

Structure

x-ray diffraction · 4 distinct chains · 43% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASuccinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial (EC 1.3.5.1)protein61333% helix, 23% strandQ0QF01
BSuccinate dehydrogenase [ubiquinone] iron-sulfur subunit, mitochondrial (EC 1.3.5.1)protein23930% helix, 14% strandQ007T0
CSuccinate dehydrogenase cytochrome B560 subunit, mitochondrialprotein13874% helix, 1% strandD0VWV4
DSuccinate dehydrogenase [ubiquinone] cytochrome B small subunit, mitochondrialprotein10286% helix, 0% strandA5GZW8

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · chains A
  • OAA · Oxaloacetate ion · ligand · chains A
  • FES · Fe2/s2 (inorganic) cluster · ligand · chains B
  • SF4 · Iron/sulfur cluster · ligand · chains B
  • F3S · FE3-S4 cluster · ligand · chains B
  • HEM · Protoporphyrin IX containing Fe · ligand · chains B, C, D
  • PCI · Pentachlorophenol · ligand · chains B, C, D

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

Pockets

15 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110530.860.8691HEM, PCI
22980.850.9551FAD, OAA
3820.730.9620empty
43320.700.8331empty
54370.680.8041empty

Interfaces

5 interfaces between chains.

  • A–B · 2701 Ų buried · 49 hydrogen bonds · protein-protein
  • B–C · 1754 Ų buried · 14 hydrogen bonds · protein-protein
  • C–D · 1296 Ų buried · 10 hydrogen bonds · protein-protein
  • B–D · 645 Ų buried · 16 hydrogen bonds · protein-protein
  • A–C · 130 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 3SFD · crystal structure of porcine mitochondrial respiratory complex II bound with oxaloacetate… · the same entry in another collection · chain C against C, TM-score 1.00
  • Q0QF01 · 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
  • Q007T0 · AlphaFold monomer V2.0 prediction for succinate dehydrogenase [ubiquinone] iron-sulfur… · a predicted model of the same protein · chain B against A, TM-score 0.99
  • A5GZW8 · 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
  • D0VWV4 · AlphaFold monomer V2.0 prediction for succinate dehydrogenase cytochrome B560 subunit… · a predicted model of the same protein · chain C against A, TM-score 0.93

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