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X-ray crystal structure of cyclic-pip and DNA complex in a reverse binding orientation

Analyse X-ray crystal structure of cyclic-pip and DNA complex in a reverse binding… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6M5B
Type
DNA
Length
10 nucleotides
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*CP*(CBR)P*AP*GP*GP*CP*CP*TP*GP*G)-3')
Ligands
S7E, MG, NA

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA (5'-D(*CP*(CBR)P*AP*GP*GP*CP*CP*TP*GP*G)-3')dna10——

Ligands and binding sites

  • S7E · 4-[[4-[(4-azanyl-1-methyl-pyrrol-2-yl)carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-~{N}-[2-[[(3~{S})-3-azanyl-4-oxidanylidene-butyl]carbamoyl]-1-methyl-imidazol-4-yl]-1-methyl-imidazole-2-carboxamide · ligand · chains A
  • MG · Magnesium ion · metal · chains A
  • NA · Sodium ion · metal
  • EDO · 1,2-ethanediol · additive

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

Modifications

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

Compared structures

  • 6M5B · X-ray crystal structure of cyclic-PIP and DNA complex in a reverse binding orientation · the same entry in another collection · chain A against A, TM-score 1.00

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