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MolNFT v1 · #7926 · protein

Cation promoted association (cpa) of a regulatory and target protein is controlled by phosphorylation

1GLD · Glucose-specific protein iiiglc: “Cation promoted association (cpa) of a regulatory and target protein is controlled by phosphorylation”. X-ray diffraction, 3 ligands (G3H, ADP, MN), 6 pockets (best druggability 0.70). MolNFT v1…

PDB
1GLD
Type
protein
Length
650 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glucose-specific protein iiiglc; Glycerol kinase
EC
2.7.1.69, 2.7.1.30
UniProt
P69783, P0A6F3
Ligands
G3H, ADP, MN
Pockets
6 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 31% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
FGlucose-specific protein iiiglc (EC 2.7.1.69)protein16112% helix, 38% strandP69783
GGlycerol kinase (EC 2.7.1.30)protein48937% helix, 25% strandP0A6F3

Ligands and binding sites

  • G3H · Glyceraldehyde-3-phosphate · ligand · chains G
  • ADP · Adenosine-5'-diphosphate · ligand · chains G
  • MN · Manganese (II) ion · metal · chains G

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

Pockets

6 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13620.700.8344MN, G3H, ADP
21430.550.8121empty
32600.530.7629empty
4840.380.7719empty
5590.300.7619empty

Interfaces

1 interface between chains.

  • F–G · 626 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 1GLD · Cation promoted association (cpa) of a regulatory and target protein is controlled by… · the same entry in another collection · chain F against F, TM-score 1.00
  • P0A6F3 · AlphaFold monomer V2.0 prediction for glycerol kinase (P0A6F3) · a predicted model of the same protein · chain G against A, TM-score 0.98
  • P69783 · AlphaFold monomer V2.0 prediction for pts system glucose-specific eiia component (P69783) · a predicted model of the same protein · chain F against A, TM-score 0.92

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