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MolNFT v1 · #7924 · protein

Structure of the regulatory complex of escherichia COLI iiiglc with glycerol kinase

1GLB · Glucose-specific protein iiiglc: “Structure of the regulatory complex of escherichia COLI iiiglc with glycerol kinase”. X-ray diffraction, 1 ligand (ADP), 7 pockets (best druggability 0.66). MolNFT v1 #7924 on GenesisL1: 3D…

PDB
1GLB
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
ADP
Pockets
7 · best druggability 0.66

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
FGlucose-specific protein iiiglc (EC 2.7.1.69)protein16112% helix, 40% strandP69783
GGlycerol kinase (EC 2.7.1.30)protein48933% helix, 24% strandP0A6F3

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains G
  • GOL · Glycerol · additive · chains G

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13840.660.7945ADP, GOL
23400.610.7836empty
31510.600.8425empty
4530.420.8213empty
5820.370.7726empty

Interfaces

1 interface between chains.

  • F–G · 697 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 1GLB · Structure of the regulatory complex of escherichia COLI iiiglc with glycerol kinase · 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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