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Crystal structure of SO_1444-SO_1445 complex from shewanella oneidensis

Analyse Crystal structure of SO_1444-SO_1445 complex from shewanella oneidensis in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7ETR
Type
protein
Length
315 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transcriptional regulator copg family; Toxin module of toxin-antitoxin system RELE/STBE…
UniProt
Q8EGZ2, Q8EGZ3
Pockets
3 · best druggability 0.58

Structure

x-ray diffraction · 4 distinct chains · 49% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATranscriptional regulator copg familyprotein8863% helix, 8% strandQ8EGZ2
BTranscriptional regulator copg familyprotein7363% helix, 7% strandQ8EGZ2
CToxin module of toxin-antitoxin system RELE/STBE familyprotein8237% helix, 21% strandQ8EGZ3
DToxin module of toxin-antitoxin system RELE/STBE familyprotein7233% helix, 18% strandQ8EGZ3

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13050.580.7734empty
22480.550.7729empty
3530.380.8119empty

Interfaces

4 interfaces between chains.

  • A–B · 1891 Ų buried · 25 hydrogen bonds · protein-protein
  • A–C · 1205 Ų buried · 8 hydrogen bonds · protein-protein
  • B–D · 635 Ų buried · 5 hydrogen bonds · protein-protein
  • C–D · 157 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 modified (engineered).

Compared structures

  • 7ETR · Crystal structure of SO_1444-SO_1445 complex from Shewanella oneidensis · the same entry in another collection · chain A against A, TM-score 1.00

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