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Cryoem structure of pyocin R2 - precontracted - trunk

Analyse Cryoem structure of pyocin R2 - precontracted - trunk in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6PYT
Type
protein
Length
6,624 residues
Chains
24
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pyocin tube PA0623; Pyocin sheath PA0622
UniProt
Q9I5S9, G3XD39
Pockets
20 · best druggability 0.79

Structure

electron microscopy · 2 distinct chains · 24% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
m, a, n, o, p, q, r, b, c, d, e, fPyocin tube PA0623protein1677% helix, 49% strandQ9I5S9
M, A, N, O, P, Q, R, B, C, D, E, FPyocin sheath PA0622protein38531% helix, 22% strandG3XD39

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111130.790.8199empty
210310.780.8085empty
310340.780.8098empty
49520.780.8076empty
59750.780.8072empty

Interfaces

90 interfaces between chains.

  • P–D · 2279 Ų buried · 30 hydrogen bonds · protein-protein
  • R–F · 2274 Ų buried · 27 hydrogen bonds · protein-protein
  • M–A · 2271 Ų buried · 25 hydrogen bonds · protein-protein
  • Q–E · 2268 Ų buried · 26 hydrogen bonds · protein-protein
  • O–C · 2265 Ų buried · 26 hydrogen bonds · protein-protein

Compared structures

  • 6PYT · CryoEM Structure of Pyocin R2 - precontracted - trunk · the same entry in another collection · chain m against m, TM-score 1.00

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