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MolNFT v1 · #149849 · protein

Crystal structure of glutathione transferase XI 3 from trametes versicolor in complex with glutathione

6GCB: “Crystal structure of glutathione transferase XI 3 from trametes versicolor in complex with glutathione”. X-ray diffraction, 1 ligand (GSH), 3 pockets (best druggability 0.75). MolNFT v1 #149849 on GenesisL1: 3D structure, binding…

PDB
6GCB
Type
protein
Length
584 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutathione transferase XI 3 from trametes versicolor
Ligands
GSH
Pockets
3 · best druggability 0.75

Structure

x-ray diffraction · 2 distinct chains · 46% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlutathione transferase XI 3 from trametes versicolorprotein29345% helix, 8% strand—
BGlutathione transferase XI 3 from trametes versicolorprotein29146% helix, 8% strand—

Ligands and binding sites

  • GSH · Glutathione · ligand · 2 copies · chains A, B

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

Pockets

3 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12500.750.8946empty
24060.620.7737GSH
32950.540.7534GSH

Interfaces

1 interface between chains.

  • A–B · 1144 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 6GCB · Crystal structure of glutathione transferase Xi 3 from Trametes versicolor in complex… · the same entry in another collection · chain A against A, TM-score 1.00

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