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MolNFT v1 · #185826 · protein

Cryo-EM structure of ldh-etfab complex from acetobacterium woodii

7QH2 · Lactate dehydrogenase (NAD(+),FERREDOXIN) subunit lctc: “Cryo-EM structure of ldh-etfab complex from acetobacterium woodii”. Electron microscopy, 2 ligands (FAD, FE), 20 pockets (best druggability 0.87). MolNFT v1 #185826 on…

PDB
7QH2
Type
protein
Length
2,138 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lactate dehydrogenase (NAD(+),FERREDOXIN) subunit lctc; Lactate dehydrogenase…
EC
1.3.1.110
UniProt
H6LBB1, H6LBB0, H6LBS1
Ligands
FAD, FE
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 3 distinct chains · 32% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DLactate dehydrogenase (NAD(+),FERREDOXIN) subunit lctc (EC 1.3.1.110)protein33729% helix, 26% strandH6LBB1
B, ELactate dehydrogenase (NAD(+),FERREDOXIN) subunit lctb (EC 1.3.1.110)protein26526% helix, 26% strandH6LBB0
C, FLactate dehydrogenase (NAD(+),FERREDOXIN) subunit lctd (EC 1.3.1.110)protein46739% helix, 20% strandH6LBS1

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · 6 copies · chains A, C, B, D, F, E
  • FE · Fe (III) ion · metal · 2 copies · chains C, F

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110530.870.89108empty
27810.850.8880FAD
37410.840.8878FAD
45780.730.8157FAD
55950.730.8063FAD

Interfaces

7 interfaces between chains.

  • D–E · 3617 Ų buried · 51 hydrogen bonds · protein-protein
  • A–B · 3596 Ų buried · 44 hydrogen bonds · protein-protein
  • C–F · 3187 Ų buried · 31 hydrogen bonds · protein-protein
  • E–F · 852 Ų buried · 13 hydrogen bonds · protein-protein
  • B–C · 828 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 7QH2 · Cryo-EM structure of Ldh-EtfAB complex from Acetobacterium woodii · the same entry in another collection · chain A against A, TM-score 1.00

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