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Crystallizing strained DNA: self-assembly of 3D crystals containing a torsionally-stressed component

Analyse Crystallizing strained DNA: self-assembly of 3D crystals containing a… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5EOS
Type
DNA
Length
42 nucleotides
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(P*GP*AP*GP*CP*AP*GP*CP*TP*GP*TP*G)-3'); DNA…
Pockets
1 · best druggability 0.37

Structure

x-ray diffraction · 4 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA (5'-D(P*GP*AP*GP*CP*AP*GP*CP*TP*GP*TP*G)-3')dna11——
DDNA (5'-D(P*CP*AP*CP*AP*CP*CP*GP*T)-3')dna8——
BDNA (5'-D(*TP*CP*TP*GP*AP*TP*GP*TP*GP*CP*TP*GP*C)-3')dna13——
CDNA (5'-D(P*AP*CP*GP*GP*AP*CP*AP*TP*CP*A)-3')dna10——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11420.370.7316empty

Interfaces

6 interfaces between chains.

  • B–C · 287 Ų buried · 10 hydrogen bonds · nucleic-nucleic
  • D–B · 267 Ų buried · 7 hydrogen bonds · nucleic-nucleic
  • A–B · 254 Ų buried · 15 hydrogen bonds · nucleic-nucleic
  • D–C · 192 Ų buried · 9 hydrogen bonds · nucleic-nucleic
  • A–D · 184 Ų buried · 4 hydrogen bonds · nucleic-nucleic

Compared structures

  • 5EOS · Crystallizing Strained DNA: Self-Assembly of 3D Crystals Containing a… · the same entry in another collection · chain A against A, TM-score 1.00

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