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MolNFT v1 · #15303 · DNA

NMR structure of D(CCAAGGXCTTGGG), X is a 3'-phosphoglycolate, 5'- phosphate gapped lesion, 10 structures

1N0O · 5'-D(*CP*CP*AP*AP*GP*G)-3': “NMR structure of D(CCAAGGXCTTGGG), X is a 3'-phosphoglycolate, 5'- phosphate gapped lesion, 10 structures”. Solution nmr, 1 ligand (PGA). MolNFT v1 #15303 on GenesisL1: 3D structure, binding sites and…

PDB
1N0O
Type
DNA
Length
25 nucleotides
Chains
3
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*CP*CP*AP*AP*GP*G)-3'; 5'-D(P*CP*TP*TP*GP*GP*G)-3'…
Ligands
PGA

Structure

solution nmr · 3 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'-D(*CP*CP*AP*AP*GP*G)-3'dna6——
B5'-D(P*CP*TP*TP*GP*GP*G)-3'dna6——
C5'-D(*CP*CP*CP*AP*AP*GP*GP*CP*CP*TP*TP*GP*G)-3'dna13——

Ligands and binding sites

  • PGA · 2-phosphoglycolic acid · ligand · chains A

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

Interfaces

2 interfaces between chains.

  • A–C · 310 Ų buried · 29 hydrogen bonds · nucleic-nucleic
  • B–C · 305 Ų buried · 27 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 1N0O · NMR Structure of d(CCAAGGXCTTGGG), X is a 3'-phosphoglycolate, 5'-phosphate gapped… · the same entry in another collection · chain A against A, TM-score 1.00

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