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1.4 ångström crystal structure of ABC transporter glutathione-binding protein gsht from streptococcus pneumoniae strain canada MDR_19A in complex with glutathione

Analyse 1.4 ångström crystal structure of ABC transporter glutathione-binding protein… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4EQ9
Type
protein
Length
240 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ABC transporter substrate-binding protein-amino acid transport
UniProt
Q8DRG2
Ligands
GSH
Pockets
1 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 37% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AABC transporter substrate-binding protein-amino acid transportprotein24037% helix, 23% strandQ8DRG2

Ligands and binding sites

  • GSH · Glutathione · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13670.740.8549GSH

Compared structures

  • 4EQ9 · 1.4 Angstrom Crystal Structure of ABC Transporter Glutathione-Binding Protein GshT from… · the same entry in another collection · chain A against A, TM-score 1.00

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