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MolNFT v1 · #171334 · protein

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

6Z1E · Ribulose bisphosphate CARBOXYLASE/OXYGENASE activase: “Crystal structure of the aaa domain of rubisco activase from nostoc sp. (strain pcc 7120)”. X-ray diffraction, 2 ligands (ADP, CL), 5 pockets (best druggability 0.77). MolNFT v1…

PDB
6Z1E
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, CL
Pockets
5 · best druggability 0.77

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 activaseprotein25954% helix, 10% strandP58555

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A, B
  • CL · Chloride ion · ion · 3 copies · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111140.770.7973ADP
21660.470.7622empty
3850.370.7617empty
4630.360.7814empty
5530.280.7515empty

Interfaces

1 interface between chains.

  • A–B · 1328 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 6Z1E · Crystal structure of the AAA domain of Rubisco Activase from Nostoc sp. (strain PCC 7120) · 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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