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MolNFT v1 · #149515 · protein

Crystal structure of the human glutamate dehydrogenase 2 (HGDH2)

6G2U · Glutamate dehydrogenase 2, mitochondrial: “Crystal structure of the human glutamate dehydrogenase 2 (HGDH2)”. X-ray diffraction, 3 ligands (NA, PO4, CL), 20 pockets (best druggability 0.88). MolNFT v1 #149515 on GenesisL1: 3D…

PDB
6G2U
Type
protein
Length
2,960 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutamate dehydrogenase 2, mitochondrial
EC
1.4.1.3
UniProt
P49448
Ligands
NA, PO4, CL
Pockets
20 · best druggability 0.88

Structure

x-ray diffraction · 4 distinct chains · 49% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlutamate dehydrogenase 2, mitochondrial (EC 1.4.1.3)protein49450% helix, 14% strandP49448
B, CGlutamate dehydrogenase 2, mitochondrial (EC 1.4.1.3)protein49149% helix, 15% strandP49448
D, FGlutamate dehydrogenase 2, mitochondrial (EC 1.4.1.3)protein49650% helix, 14% strandP49448
EGlutamate dehydrogenase 2, mitochondrial (EC 1.4.1.3)protein49249% helix, 14% strandP49448

Ligands and binding sites

  • NA · Sodium ion · metal · 21 copies · chains A, C, D, B, E, F
  • PO4 · Phosphate ion · ion · 23 copies · chains A, D, B, E, C, F
  • CL · Chloride ion · ion · 19 copies · chains A, B, D, C, 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, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17670.880.9167PO4
211050.840.85137PO4, CL, NA
33270.830.9251empty
48270.770.8186PO4
56780.760.8266PO4, NA

Interfaces

10 interfaces between chains.

  • B–D · 1781 Ų buried · 19 hydrogen bonds · protein-protein
  • A–D · 1779 Ų buried · 20 hydrogen bonds · protein-protein
  • C–F · 1755 Ų buried · 15 hydrogen bonds · protein-protein
  • A–B · 1746 Ų buried · 15 hydrogen bonds · protein-protein
  • A–E · 476 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 6G2U · Crystal structure of the human glutamate dehydrogenase 2 (hGDH2) · the same entry in another collection · chain F against F, TM-score 1.00
  • P49448 · AlphaFold monomer V2.0 prediction for glutamate dehydrogenase 2, mitochondrial (P49448) · a predicted model of the same protein · chain E against A, TM-score 0.95

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