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MolNFT v1 · #11970 · DNA

Structural characterization of bisintercalation in higher- order DNA at a junction-like quadruplex

1K2L · 5'-D(*CP*GP*TP*AP*CP*G)-3': “Structural characterization of bisintercalation in higher- order DNA at a junction-like quadruplex”. X-ray diffraction, 2 ligands (BDC, CO). MolNFT v1 #11970 on GenesisL1: 3D structure, binding sites and…

PDB
1K2L
Type
DNA
Length
11 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*CP*GP*TP*AP*CP*G)-3'
Ligands
BDC, CO

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'-D(*CP*GP*TP*AP*CP*G)-3'dna6——
B5'-D(*CP*GP*TP*AP*CP*G)-3'dna5——

Ligands and binding sites

  • BDC · Bis-(9-octylamino(2-dimethylaminoethyl)acridine-4-carboxamide · ligand · chains A, B
  • CO · Cobalt (II) ion · metal · 2 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 · 176 Ų buried · 14 hydrogen bonds · nucleic-nucleic

Compared structures

  • 1K2L · Structural characterization of bisintercalation in higher-order DNA at a junction-like… · the same entry in another collection · chain A against A, TM-score 1.00

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