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Crystal structure of ybjn, a putative transcription regulator from E. COLI

Analyse Crystal structure of ybjn, a putative transcription regulator from E. COLI in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6VU7
Type
protein
Length
562 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ybjn protein
UniProt
B7LD46
Ligands
CL
Pockets
8 · best druggability 0.78

Structure

x-ray diffraction · 4 distinct chains · 38% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AYbjn proteinprotein14138% helix, 26% strandB7LD46
BYbjn proteinprotein14238% helix, 27% strandB7LD46
CYbjn proteinprotein14438% helix, 25% strandB7LD46
DYbjn proteinprotein13536% helix, 28% strandB7LD46

Ligands and binding sites

  • CL · Chloride ion · ion · 2 copies · chains A, C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11160.780.9737empty
2790.740.9730empty
34420.690.8055empty
41340.470.7717empty
51040.440.7816empty

Interfaces

4 interfaces between chains.

  • C–D · 1202 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 1188 Ų buried · 19 hydrogen bonds · protein-protein
  • B–C · 864 Ų buried · 8 hydrogen bonds · protein-protein
  • B–D · 97 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 6VU7 · Crystal structure of YbjN, a putative transcription regulator from E. coli · the same entry in another collection · chain A against A, TM-score 1.00

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