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Structure of a R371A mutant of a Group II PLP dependent decarboxylase from Methanocaldococcus jannaschii

Analyse Structure of a R371A mutant of a Group II PLP dependent decarboxylase from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6M4Y
Type
protein
Length
389 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.1
Source
Methanocaldococcus jannaschii (strain ATCC 43067 / DSM 2661 / JAL-1 / JCM 10045…
Molecule
L-tyrosine/L-aspartate decarboxylase
EC
4.1.1.11, 4.1.1.25
UniProt
Q60358
Ligands
SO4
Pockets
2 · best druggability 0.31

Structure

x-ray diffraction · resolution 2.1 · 1 distinct chain · 46% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AL-tyrosine/L-aspartate decarboxylase (EC 4.1.1.11, 4.1.1.25)protein38946% helix, 14% strandQ60358

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 4 copies · chains A
  • GOL · Glycerol · additive · 2 copies · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1550.310.7616SO4
2640.290.7316empty

Modifications

Observed in the structure: 1 modified (cofactor).

Compared structures

  • 6M4Y · Structure of a R371A mutant of a group II plp dependent decarboxylase from… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q60358 · AlphaFold monomer V2.0 prediction for L-TYROSINE/L-aspartate decarboxylase (Q60358) · a predicted model of the same protein · chain A against A, TM-score 0.99

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