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MolNFT v1 · #63984 · DNA

Crystal structure of D(CACGCG).D(CGCGTG) with 10MM MNCL2

3FQ5 · 5'-D(*CP*AP*CP*GP*CP*G)-3': “Crystal structure of D(CACGCG).D(CGCGTG) with 10MM MNCL2”. X-ray diffraction, 1 ligand (MN). MolNFT v1 #63984 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3FQ5
Type
DNA
Length
24 nucleotides
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*CP*AP*CP*GP*CP*G)-3'; 5'-D(*CP*GP*CP*GP*TP*G)-3'
Ligands
MN

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C5'-D(*CP*AP*CP*GP*CP*G)-3'dna6——
B, D5'-D(*CP*GP*CP*GP*TP*G)-3'dna6——

Ligands and binding sites

  • MN · Manganese (II) ion · metal · 2 copies · chains A, D

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

Interfaces

5 interfaces between chains.

  • C–D · 335 Ų buried · 31 hydrogen bonds · nucleic-nucleic
  • A–B · 329 Ų buried · 27 hydrogen bonds · nucleic-nucleic
  • B–D · 131 Ų buried · 0 hydrogen bonds · nucleic-nucleic
  • A–D · 46 Ų buried · 0 hydrogen bonds · nucleic-nucleic
  • A–C · 11 Ų buried · 0 hydrogen bonds · nucleic-nucleic

Compared structures

  • 3FQ5 · Crystal Structure of d(CACGCG).d(CGCGTG) with 10mM MnCl2 · the same entry in another collection · chain A against A, TM-score 1.00

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