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Crystal structure of the JUN BZIP homodimer complexed with AP-1 DNA

Analyse Crystal structure of the JUN BZIP homodimer complexed with AP-1 DNA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2H7H
Type
protein + DNA
Length
154 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.3
Source
Avian sarcoma virus; SYNTHETIC CONSTRUCT
Molecule
5'-D(*CP*GP*TP*CP*GP*AP*TP*GP*AP*CP*TP*CP*AP*TP*CP*GP*AP*CP*G)-3'…
UniProt
P05411
Pockets
3 · best druggability 0.68

Structure

x-ray diffraction · resolution 2.3 · 3 distinct chains · 93% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
X5'-D(*CP*GP*TP*CP*GP*AP*TP*GP*AP*CP*TP*CP*AP*TP*CP*GP*AP*CP*G)-3'dna19——
Y5'-D(*CP*GP*TP*CP*GP*AP*TP*GP*AP*GP*TP*CP*AP*TP*CP*GP*AP*CP*G)-3'dna19——
A, BViral jun transforming proteinprotein5893% helix, 0% strandP05411

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12080.680.8627empty
2720.440.8114empty
3810.440.8016empty

Interfaces

6 interfaces between chains.

  • A–B · 1094 Ų buried · 8 hydrogen bonds · protein-protein
  • X–Y · 851 Ų buried · 90 hydrogen bonds · nucleic-nucleic
  • X–B · 367 Ų buried · 9 hydrogen bonds · protein-nucleic
  • Y–A · 337 Ų buried · 7 hydrogen bonds · protein-nucleic
  • Y–B · 328 Ų buried · 6 hydrogen bonds · protein-nucleic

Compared structures

  • 2H7H · Crystal structure of the jun bzip homodimer complexed with ap-1 DNA · the same entry in another collection · chain A against A, TM-score 1.00

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