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MolNFT v1 · #64986 · DNA

Crystal structure of a DNA duplex containing 7,8- DIHYDROPYRIDOL[2,3-D]PYRIMIDIN-2-one

3GJL · 5'-D(*CP*GP*CP*GP*AP*A)-3': “Crystal structure of a DNA duplex containing 7,8- DIHYDROPYRIDOL[2,3-D]PYRIMIDIN-2-one”. X-ray diffraction, 1 ligand (NA). MolNFT v1 #64986 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3GJL
Type
DNA
Length
12 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*CP*GP*CP*GP*AP*A)-3'; 5'-D(P*TP*TP*(B7C)P*GP*CP*G)-3'
Ligands
NA

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'-D(*CP*GP*CP*GP*AP*A)-3'dna6——
B5'-D(P*TP*TP*(B7C)P*GP*CP*G)-3'dna6——

Ligands and binding sites

  • NA · Sodium ion · metal · chains B

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

Interfaces

1 interface between chains.

  • A–B · 232 Ų buried · 21 hydrogen bonds · nucleic-nucleic

Modifications

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

Compared structures

  • 3GJL · crystal structure of a DNA duplex containing 7,8-dihydropyridol[2,3-d]pyrimidin-2-one · the same entry in another collection · chain A against A, TM-score 1.00

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