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MolNFT v1 · #57165 · DNA

A novel end-to-end binding of two netropsins to the DNA decamer D(CCCCCIIIII)2

375D · DNA (5'-D(*CP*CP*CP*CP*CP*IP*IP*IP*IP*I)-3'): “A novel end-to-end binding of two netropsins to the DNA decamer D(CCCCCIIIII)2”. X-ray diffraction, 1 ligand (NT). MolNFT v1 #57165 on GenesisL1: 3D structure, binding sites and pockets…

PDB
375D
Type
DNA
Length
40 nucleotides
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*CP*CP*CP*CP*CP*IP*IP*IP*IP*I)-3')
Ligands
NT

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DDNA (5'-D(*CP*CP*CP*CP*CP*IP*IP*IP*IP*I)-3')dna10——

Ligands and binding sites

  • NT · Netropsin · ligand · 4 copies · chains A, B, C, D

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

Interfaces

3 interfaces between chains.

  • C–D · 421 Ų buried · 45 hydrogen bonds · nucleic-nucleic
  • A–B · 417 Ų buried · 39 hydrogen bonds · nucleic-nucleic
  • A–C · 70 Ų buried · 2 hydrogen bonds · nucleic-nucleic

Compared structures

  • 375D · A novel end-to-end binding of two netropsins to the DNA decamer D(CCCCCIIIII)2 · the same entry in another collection · chain A against A, TM-score 1.00

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