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Crystal structure of pig muscle phosphoglycerate kinase ternary complex with AMP-pcp and 3PG

Analyse Crystal structure of pig muscle phosphoglycerate kinase ternary complex with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1KF0
Type
protein
Length
416 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoglycerate kinase
EC
2.7.2.3
UniProt
Q7SIB7
Ligands
3PG, ACP, MG
Pockets
2 · best druggability 0.61

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoglycerate kinase (EC 2.7.2.3)protein41638% helix, 17% strandQ7SIB7

Ligands and binding sites

  • 3PG · 3-phosphoglyceric acid · ligand · chains A
  • ACP · Phosphomethylphosphonic acid adenylate ester · ligand · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14060.610.77713PG, ACP
2600.320.7615empty

Compared structures

  • 1KF0 · Crystal Structure of Pig Muscle Phosphoglycerate Kinase Ternary Complex with AMP-PCP and… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q7SIB7 · AlphaFold monomer V2.0 prediction for phosphoglycerate kinase 1 (Q7SIB7) · a predicted model of the same protein · chain A against A, TM-score 0.98

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