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Crystal structure of an universal stress protein family protein from arabidopsis thaliana AT3G01520 with AMP bound

Analyse Crystal structure of an universal stress protein family protein from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2GM3
Type
protein
Length
905 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Unknown protein
UniProt
Q8LGG8
Ligands
AMP
Pockets
11 · best druggability 0.72

Structure

x-ray diffraction · 3 distinct chains · 41% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, D, EUnknown proteinprotein15342% helix, 24% strandQ8LGG8
BUnknown proteinprotein14540% helix, 25% strandQ8LGG8
FUnknown proteinprotein14841% helix, 24% strandQ8LGG8

Ligands and binding sites

  • AMP · Adenosine monophosphate · ligand · 6 copies · chains A, B, C, D, E, F

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14980.720.8167AMP
25490.710.8079AMP
36010.710.7986AMP
42820.520.7434empty
51760.460.7621empty

Interfaces

7 interfaces between chains.

  • A–B · 1073 Ų buried · 27 hydrogen bonds · protein-protein
  • E–F · 1064 Ų buried · 28 hydrogen bonds · protein-protein
  • C–D · 1053 Ų buried · 25 hydrogen bonds · protein-protein
  • C–E · 871 Ų buried · 8 hydrogen bonds · protein-protein
  • A–E · 182 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 18 modified (engineered).

Compared structures

  • 2GM3 · Crystal Structure of an Universal Stress Protein Family Protein from Arabidopsis Thaliana… · the same entry in another collection · chain F against F, TM-score 1.00
  • Q8LGG8 · AlphaFold monomer V2.0 prediction for universal stress protein a-like protein (Q8LGG8) · a predicted model of the same protein · chain A against A, TM-score 0.90

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