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MolNFT v1 · #1579 · DNA

3,N4-etheno-2'-deoxycytidine opposite cytidine in an 11-mer duplex, solution structure from NMR and molecular dynamics

1B60 · DNA (5'-D(*CP*GP*TP*AP*CP*(EDC)P*CP*AP*TP*GP*C)-3'): “3,N4-etheno-2'-deoxycytidine opposite cytidine in an 11-mer duplex, solution structure from NMR and molecular…”. Solution nmr. MolNFT v1 #1579 on GenesisL1: 3D structure, binding…

PDB
1B60
Type
DNA
Length
22 nucleotides
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*CP*GP*TP*AP*CP*(EDC)P*CP*AP*TP*GP*C)-3'); DNA…

Structure

solution nmr · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA (5'-D(*CP*GP*TP*AP*CP*(EDC)P*CP*AP*TP*GP*C)-3')dna11——
BDNA (5'-D(*GP*CP*AP*TP*GP*CP*GP*TP*AP*CP*G)-3')dna11——

Interfaces

1 interface between chains.

  • A–B · 536 Ų buried · 64 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 1 modified (nucleotide modification).

Compared structures

  • 1B60 · 3,N4-etheno-2'-deoxycytidine opposite cytidine in an 11-mer duplex, solution structure… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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