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MolNFT v1 · #11930 · DNA

Heteroduplex of chirally pure METHYLPHOSPHONATE/DNA duplex

1K1H · 5'-D(*TP*GP*TP*TP*TP*GP*GP*C)-3': “Heteroduplex of chirally pure METHYLPHOSPHONATE/DNA duplex”. Solution nmr. MolNFT v1 #11930 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1K1H
Type
DNA
Length
15 nucleotides
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*TP*GP*TP*TP*TP*GP*GP*C)-3'; 5'-D(*CP*(CMR)P*(RMP)P*(RMP)P*(SMP)P*(CMR)P*(RMP))-3'

Structure

solution nmr · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'-D(*TP*GP*TP*TP*TP*GP*GP*C)-3'dna8——
B5'-D(*CP*(CMR)P*(RMP)P*(RMP)P*(SMP)P*(CMR)P*(RMP))-3'dna7——

Interfaces

1 interface between chains.

  • A–B · 327 Ų buried · 26 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 6 modified (nucleotide modification).

Compared structures

  • 1K1H · Heteroduplex of chirally pure METHYLPHOSPHONATE/DNA duplex · the same entry in another collection · chain A against A, TM-score 1.00

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