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Crystal structure of the zalpha Z-DNA complex

Analyse Crystal structure of the zalpha Z-DNA complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1QBJ
Type
protein + DNA
Length
212 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*TP*CP*GP*CP*GP*CP*G)-3'); Protein (double-stranded RNA specific adenosine…
UniProt
P55265
Pockets
2 · best druggability 0.50

Structure

x-ray diffraction · 4 distinct chains · 56% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
D, E, FDNA (5'-D(*TP*CP*GP*CP*GP*CP*G)-3')dna6——
AProtein (double-stranded RNA specific adenosine deaminase (ADAR1))protein6557% helix, 14% strandP55265
BProtein (double-stranded RNA specific adenosine deaminase (ADAR1))protein6354% helix, 14% strandP55265
CProtein (double-stranded RNA specific adenosine deaminase (ADAR1))protein6658% helix, 12% strandP55265

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12340.500.7519empty
21910.490.7724empty

Interfaces

7 interfaces between chains.

  • F–C · 428 Ų buried · 7 hydrogen bonds · protein-nucleic
  • E–B · 427 Ų buried · 10 hydrogen bonds · protein-nucleic
  • D–A · 404 Ų buried · 8 hydrogen bonds · protein-nucleic
  • D–E · 326 Ų buried · 28 hydrogen bonds · nucleic-nucleic
  • B–C · 184 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 1QBJ · Crystal structure of the zalpha Z-DNA complex · the same entry in another collection · chain C against C, TM-score 1.00
  • P55265 · AlphaFold monomer V2.0 prediction for double-stranded RNA-specific adenosine deaminase… · a predicted model of the same protein · chain B against A, TM-score 0.97

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