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MolNFT v1 · #28485 · protein

Versatile modes of peptide recognition by the aaa+ adaptor protein sspb- the crystal structure of a sspb-rsea complex

1YFN · Stringent starvation protein B: “Versatile modes of peptide recognition by the aaa+ adaptor protein sspb- the crystal structure of a sspb-rsea…”. X-ray diffraction, 4 pockets (best druggability 0.59). MolNFT v1 #28485 on GenesisL1…

PDB
1YFN
Type
protein
Length
493 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Stringent starvation protein B; Sigma-E factor negative regulatory protein
UniProt
P0AFZ3, P38106
Pockets
4 · best druggability 0.59

Structure

x-ray diffraction · 4 distinct chains · 23% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AStringent starvation protein Bprotein10921% helix, 39% strandP0AFZ3
B, C, DStringent starvation protein Bprotein10721% helix, 40% strandP0AFZ3
ESigma-E factor negative regulatory proteinprotein1850% helix, 0% strandP38106
F, G, HSigma-E factor negative regulatory proteinprotein1527% helix, 0% strandP38106

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13330.590.7733empty
21070.410.7617empty
31000.400.7617empty
4620.350.7822empty

Interfaces

8 interfaces between chains.

  • A–E · 879 Ų buried · 7 hydrogen bonds · protein-protein
  • D–H · 790 Ų buried · 11 hydrogen bonds · protein-protein
  • B–F · 785 Ų buried · 7 hydrogen bonds · protein-protein
  • C–G · 780 Ų buried · 9 hydrogen bonds · protein-protein
  • A–B · 760 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 1YFN · Versatile modes of peptide recognition by the AAA+ adaptor protein SspB- the crystal… · the same entry in another collection · chain C against C, TM-score 1.00
  • P0AFZ3 · AlphaFold monomer V2.0 prediction for stringent starvation protein B (P0AFZ3) · a predicted model of the same protein · chain B against A, TM-score 0.99

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