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The structure of rat cytosolic pepck variant E89Q in complex with GTP

Analyse The structure of rat cytosolic pepck variant E89Q in complex with GTP in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5FH2
Type
protein
Length
613 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoenolpyruvate carboxykinase, cytosolic [GTP]
EC
4.1.1.32
UniProt
P07379
Ligands
GTP, MN, NA
Pockets
8 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 31% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoenolpyruvate carboxykinase, cytosolic [GTP] (EC 4.1.1.32)protein61331% helix, 23% strandP07379

Ligands and binding sites

  • GTP · Guanosine-5'-triphosphate · ligand · chains A
  • MN · Manganese (II) ion · metal · 2 copies · chains A
  • NA · Sodium ion · metal · chains A
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid · additive · chains A

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

Pockets

8 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18950.770.8076MN, GTP, EPE
21640.600.8320empty
3810.450.8018empty
4720.420.8025empty
5740.380.7715empty

Compared structures

  • 5FH2 · The structure of rat cytosolic PEPCK variant E89Q in complex with GTP · the same entry in another collection · chain A against A, TM-score 1.00

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