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XI class GST from natrialba magadii

Analyse XI class GST from natrialba magadii in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6GZF
Type
protein
Length
647 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutathione S-transferase
EC
2.5.1.18
UniProt
D3SS28
Ligands
SO4
Pockets
5 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlutathione S-transferase (EC 2.5.1.18)protein32738% helix, 10% strandD3SS28
BGlutathione S-transferase (EC 2.5.1.18)protein32036% helix, 12% strandD3SS28

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains A, B

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

Pockets

5 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12790.740.8733empty
22090.720.8834empty
3590.720.9822SO4
42660.530.7628empty
5550.250.7216empty

Interfaces

1 interface between chains.

  • A–B · 1347 Ų buried · 25 hydrogen bonds · protein-protein

Compared structures

  • 6GZF · Xi Class GST from Natrialba magadii · the same entry in another collection · chain A against A, TM-score 1.00

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