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OhrB (Organic Hydroperoxide Resistance protein) wild type from Chromobacterium violaceum and reduced by DTT

Analyse OhrB (Organic Hydroperoxide Resistance protein) wild type from Chromobacterium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6EBC
Type
protein
Length
565 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.87
Source
Chromobacterium violaceum
Molecule
Organic hydroperoxide resistance protein
UniProt
A0A202B6V5
Ligands
CL
Pockets
5 · best druggability 0.76

Structure

x-ray diffraction · resolution 1.87 · 3 distinct chains · 32% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, COrganic hydroperoxide resistance proteinprotein14033% helix, 32% strandA0A202B6V5
BOrganic hydroperoxide resistance proteinprotein14332% helix, 32% strandA0A202B6V5
DOrganic hydroperoxide resistance proteinprotein14232% helix, 32% strandA0A202B6V5

Ligands and binding sites

  • CL · Chloride ion · ion · 7 copies · chains A, C, B, D
  • DTT · 2,3-dihydroxy-1,4-dithiobutane · additive · 3 copies · chains B, D, A, C

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

5 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18960.760.8087CL
22520.660.8337empty
33050.650.8144DTT
42170.650.8330DTT
52720.640.8136DTT

Interfaces

6 interfaces between chains.

  • B–D · 3371 Ų buried · 71 hydrogen bonds · protein-protein
  • A–C · 3147 Ų buried · 62 hydrogen bonds · protein-protein
  • A–B · 258 Ų buried · 6 hydrogen bonds · protein-protein
  • B–C · 112 Ų buried · 1 hydrogen bond · protein-protein
  • C–D · 79 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 6EBC · Ohrb (organic hydroperoxide resistance protein) wild type from chromobacterium violaceum… · the same entry in another collection · chain A against A, TM-score 1.00

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