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Crystal structure of phosphoglyceromutase from burkholderia pseudomallei 1710B

Analyse Crystal structure of phosphoglyceromutase from burkholderia pseudomallei 1710B in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3EZN
Type
protein
Length
467 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
2,3-bisphosphoglycerate-dependent phosphoglycerate mutase
EC
5.4.2.1
UniProt
Q3JWH7
Pockets
6 · best druggability 0.56

Structure

x-ray diffraction · 2 distinct chains · 43% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A2,3-bisphosphoglycerate-dependent phosphoglycerate mutase (EC 5.4.2.1)protein23644% helix, 15% strandQ3JWH7
B2,3-bisphosphoglycerate-dependent phosphoglycerate mutase (EC 5.4.2.1)protein23143% helix, 16% strandQ3JWH7

Ligands and binding sites

  • PG4 · Tetraethylene glycol · additive · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11920.560.8128empty
21300.510.8123empty
3770.380.7711empty
41280.380.7317empty
5550.330.7817empty

Interfaces

1 interface between chains.

  • A–B · 851 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 3EZN · Crystal structure of phosphoglyceromutase from burkholderia pseudomallei 1710b · the same entry in another collection · chain A against A, TM-score 1.00
  • Q3JWH7 · AlphaFold monomer V2.0 prediction for 2,3-bisphosphoglycerate- dependent phosphoglycerate… · a predicted model of the same protein · chain A against A, TM-score 0.99

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