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Crystal structure of the aaa domain of rubisco activase from nostoc sp. (strain pcc 7120), gadolinium complex

Analyse Crystal structure of the aaa domain of rubisco activase from nostoc sp. (strain… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6Z1D
Type
protein
Length
533 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribulose bisphosphate CARBOXYLASE/OXYGENASE activase
UniProt
P58555
Ligands
ADP, GD, CL
Pockets
5 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 52% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibulose bisphosphate CARBOXYLASE/OXYGENASE activaseprotein27450% helix, 10% strandP58555
BRibulose bisphosphate CARBOXYLASE/OXYGENASE activaseprotein25955% helix, 10% strandP58555

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A, B
  • GD · Gadolinium atom · metal · 4 copies · chains A, B
  • CL · Chloride ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110440.780.8066ADP, GD
21690.500.7821empty
3650.390.7914empty
4860.360.7619empty
5530.280.7515empty

Interfaces

1 interface between chains.

  • A–B · 1410 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 6Z1D · Crystal structure of the AAA domain of Rubisco Activase from Nostoc sp. (strain PCC… · the same entry in another collection · chain A against A, TM-score 1.00
  • P58555 · AlphaFold monomer V2.0 prediction for ribulose bisphosphate CARBOXYLASE/OXYGENASE… · a predicted model of the same protein · chain B against A, TM-score 0.92

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