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Transcription factor FOSB/JUND bzip domain in its oxidized form, type- I crystal

Analyse Transcription factor FOSB/JUND bzip domain in its oxidized form, type- I crystal in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5VPB
Type
protein
Length
246 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein fosb; Transcription factor jun-D
UniProt
P53539, P17535
Ligands
CL
Pockets
3 · best druggability 0.45

Structure

x-ray diffraction · 4 distinct chains · 94% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
CProtein fosbprotein5493% helix, 0% strandP53539
DTranscription factor jun-Dprotein6695% helix, 0% strandP17535
AProtein fosbprotein5992% helix, 0% strandP53539
BTranscription factor jun-Dprotein6796% helix, 0% strandP17535

Ligands and binding sites

  • CL · Chloride ion · ion · 13 copies · chains D, C, A, B

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11360.450.7618CL
21030.420.7817CL
31090.380.7518CL

Interfaces

6 interfaces between chains.

  • C–D · 1375 Ų buried · 8 hydrogen bonds · protein-protein
  • A–B · 1343 Ų buried · 10 hydrogen bonds · protein-protein
  • C–A · 658 Ų buried · 10 hydrogen bonds · protein-protein
  • D–A · 85 Ų buried · 0 hydrogen bonds · protein-protein
  • C–B · 83 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5VPB · Transcription factor FosB/JunD bZIP domain in its oxidized form, type-I crystal · the same entry in another collection · chain A against A, TM-score 1.00
  • P17535 · AlphaFold monomer V2.0 prediction for transcription factor jun-D (P17535) · a predicted model of the same protein · chain B against A, TM-score 0.81
  • P53539 · AlphaFold monomer V2.0 prediction for protein fosb (P53539) · a predicted model of the same protein · chain C against A, TM-score 0.71

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