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Solution NMR structure of the 2:1 hoechst 33258-D(CTTTTGCAAAAG)2 complex

Analyse Solution NMR structure of the 2:1 hoechst 33258-D(CTTTTGCAAAAG)2 complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1QSX
Type
DNA
Length
24 nucleotides
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(CP*TP*TP*TP*TP*GP*CP*AP*AP*AP*AP*G)-3'
Ligands
HT, NA

Structure

solution nmr · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B5'-D(CP*TP*TP*TP*TP*GP*CP*AP*AP*AP*AP*G)-3'dna12——

Ligands and binding sites

  • HT · 2'-(4-hydroxyphenyl)-5-(4-methyl-1-piperazinyl)-2,5'-bi-benzimidazole · ligand · 2 copies · chains A, B
  • NA · Sodium ion · metal · 19 copies · chains A, B

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

Interfaces

1 interface between chains.

  • A–B · 532 Ų buried · 46 hydrogen bonds · nucleic-nucleic

Compared structures

  • 1QSX · Solution NMR structure of the 2:1 hoechst 33258-D(CTTTTGCAAAAG)2 complex · the same entry in another collection · chain A against A, TM-score 1.00

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