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Cryoem structure of football-shaped GROEL:ES2 with rubisco

Analyse Cryoem structure of football-shaped GROEL:ES2 with rubisco in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7VWX
Type
protein
Length
9,146 residues
Chains
29
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Co-chaperonin groes; Chaperonin groel; Ribulose bisphosphate carboxylase
EC
5.6.1.7, 4.1.1.39
UniProt
P0A6F9, P0A6F5, Q2RRP5
Pockets
20 · best druggability 0.90

Structure

electron microscopy · 7 distinct chains · 24% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
1, 2, P, R, T, U, V, W, XCo-chaperonin groesprotein970% helix, 33% strandP0A6F9
A, B, C, D, E, F, G, H, I, J, K, L, M, NChaperonin groel (EC 5.6.1.7)protein52451% helix, 16% strandP0A6F5
OCo-chaperonin groesprotein950% helix, 40% strandP0A6F9
Q, SCo-chaperonin groesprotein960% helix, 35% strandP0A6F9
YCo-chaperonin groesprotein963% helix, 31% strandP0A6F9
ZCo-chaperonin groesprotein950% helix, 37% strandP0A6F9
aRibulose bisphosphate carboxylase (EC 4.1.1.39)protein45918% helix, 0% strandQ2RRP5

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110680.900.92160empty
210200.900.92141empty
310510.890.91144empty
411580.890.90162empty
511110.890.90145empty

Interfaces

73 interfaces between chains.

  • E–F · 1724 Ų buried · 26 hydrogen bonds · protein-protein
  • C–D · 1606 Ų buried · 9 hydrogen bonds · protein-protein
  • H–I · 1567 Ų buried · 22 hydrogen bonds · protein-protein
  • L–M · 1562 Ų buried · 15 hydrogen bonds · protein-protein
  • F–G · 1483 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 7VWX · CryoEM structure of football-shaped GroEL:ES2 with RuBisCO · the same entry in another collection · chain H against H, TM-score 1.00

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