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Crystal structure of glutamate dehydrogenase 3 from candida albicans in complex with alpha-ketoglutarate and NADPH

Analyse Crystal structure of glutamate dehydrogenase 3 from candida albicans in complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7F79
Type
protein
Length
2,723 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutamate dehydrogenase
UniProt
A0A1D8PMH8
Ligands
NDP, AKG
Pockets
20 · best druggability 0.88

Structure

x-ray diffraction · 6 distinct chains · 49% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlutamate dehydrogenaseprotein45650% helix, 16% strandA0A1D8PMH8
BGlutamate dehydrogenaseprotein45249% helix, 16% strandA0A1D8PMH8
CGlutamate dehydrogenaseprotein45849% helix, 16% strandA0A1D8PMH8
DGlutamate dehydrogenaseprotein45449% helix, 16% strandA0A1D8PMH8
EGlutamate dehydrogenaseprotein44850% helix, 16% strandA0A1D8PMH8
FGlutamate dehydrogenaseprotein45549% helix, 16% strandA0A1D8PMH8

Ligands and binding sites

  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate · ligand · 6 copies · chains A, B, C, D, E, F
  • AKG · 2-oxoglutaric acid · ligand · 6 copies · chains A, B, C, D, E, F
  • GOL · Glycerol · additive · 5 copies · chains A, B, D, F, E

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

Pockets

20 pockets found on a 1 Å grid, 16 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14650.880.9540empty
24430.860.9447empty
34720.860.9339empty
48090.820.85114GOL
59650.790.8191NDP, AKG

Interfaces

12 interfaces between chains.

  • A–B · 1515 Ų buried · 18 hydrogen bonds · protein-protein
  • C–D · 1393 Ų buried · 16 hydrogen bonds · protein-protein
  • E–F · 1369 Ų buried · 17 hydrogen bonds · protein-protein
  • A–C · 950 Ų buried · 16 hydrogen bonds · protein-protein
  • D–F · 945 Ų buried · 15 hydrogen bonds · protein-protein

Compared structures

  • 7F79 · Crystal structure of glutamate dehydrogenase 3 from Candida albicans in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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