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Rubisco from skeletonema marinoi

Analyse Rubisco from skeletonema marinoi in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6FTL
Type
protein
Length
2,484 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribulose bisphosphate carboxylase large chain; Ribulose-1,5-bisphosphate…
EC
4.1.1.39
Ligands
CAP, MG
Pockets
20 · best druggability 0.81

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, E, GRibulose bisphosphate carboxylase large chain (EC 4.1.1.39)protein48241% helix, 16% strand—
I, J, K, LRibulose-1,5-bisphosphate CARBOXYLASE/OXYGENASE small subunitprotein13923% helix, 32% strand—

Ligands and binding sites

  • CAP · 2-carboxyarabinitol-1,5-diphosphate · ligand · 4 copies · chains A, C, E, G
  • MG · Magnesium ion · metal · 4 copies · chains A, C, E, G
  • EDO · 1,2-ethanediol · additive · 18 copies · chains A, I, J, G, C, K, E, L

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

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18140.810.84116EDO
22310.790.9346empty
3960.740.9623empty
4880.730.9617empty
51040.730.9425empty

Interfaces

20 interfaces between chains.

  • C–J · 1638 Ų buried · 21 hydrogen bonds · protein-protein
  • A–I · 1637 Ų buried · 24 hydrogen bonds · protein-protein
  • G–L · 1611 Ų buried · 24 hydrogen bonds · protein-protein
  • E–K · 1599 Ų buried · 20 hydrogen bonds · protein-protein
  • K–G · 624 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 24 modified (nonstandard, carboxylation, hydroxylation, methylation).

Compared structures

  • 6FTL · Rubisco from Skeletonema marinoi · the same entry in another collection · chain I against I, TM-score 1.00

Analyse

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