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Crystal structures of the hslvu peptidase-ATPase complex reveal an ATP-dependent proteolysis mechanism

Analyse Crystal structures of the hslvu peptidase-ATPase complex reveal an… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1G4B
Type
protein
Length
2,264 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ATP-dependent hsl protease ATP-binding subunit hslu; ATP-dependent protease hslv
EC
3.4.99.-
UniProt
P0A6H5, P0A7B8
Pockets
20 · best druggability 0.86

Structure

x-ray diffraction · 2 distinct chains · 53% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
E, F, K, LATP-dependent hsl protease ATP-binding subunit hsluprotein39361% helix, 10% strandP0A6H5
M, N, O, PATP-dependent protease hslv (EC 3.4.99.-)protein17335% helix, 30% strandP0A7B8

Pockets

20 pockets found on a 1 Å grid, 13 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111640.860.87135empty
211330.830.84105empty
37740.770.8174empty
47190.720.7887empty
57520.700.7787empty

Interfaces

13 interfaces between chains.

  • E–F · 2548 Ų buried · 66 hydrogen bonds · protein-protein
  • K–L · 1396 Ų buried · 21 hydrogen bonds · protein-protein
  • L–O · 684 Ų buried · 23 hydrogen bonds · protein-protein
  • M–P · 609 Ų buried · 2 hydrogen bonds · protein-protein
  • O–P · 576 Ų buried · 25 hydrogen bonds · protein-protein

Compared structures

  • 1G4B · Crystal structures of the hslvu peptidase-ATPase complex reveal an ATP-dependent… · the same entry in another collection · chain P against P, TM-score 1.00
  • P0A7B8 · AlphaFold monomer V2.0 prediction for ATP-dependent protease subunit hslv (P0A7B8) · a predicted model of the same protein · chain M against A, TM-score 0.98
  • P0A6H5 · AlphaFold monomer V2.0 prediction for ATP-dependent protease ATPase subunit hslu (P0A6H5) · a predicted model of the same protein · chain E against A, TM-score 0.93

Analyse

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