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NMR solution structure of BENZ[A]ANTHRACENE-dg in RAS codon 12,2; ggcagxtggtg

Analyse NMR solution structure of BENZ[A]ANTHRACENE-dg in RAS codon 12,2; ggcagxtggtg in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1MXJ
Type
DNA
Length
22 nucleotides
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*GP*GP*CP*AP*GP*GP*TP*GP*GP*TP*G)-3'; 5'-D(*CP*AP*CP*CP*AP*CP*CP*TP*GP*CP*C)-3'
Ligands
BZR

Structure

solution nmr · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'-D(*GP*GP*CP*AP*GP*GP*TP*GP*GP*TP*G)-3'dna11——
B5'-D(*CP*AP*CP*CP*AP*CP*CP*TP*GP*CP*C)-3'dna11——

Ligands and binding sites

  • BZR · 1S,2R,3S,4R-tetrahydro-benzo[a]anthracene-2,3,4-triol · ligand · chains A, B

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

Interfaces

1 interface between chains.

  • A–B · 520 Ų buried · 65 hydrogen bonds · nucleic-nucleic

Modifications

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

Compared structures

  • 1MXJ · NMR solution structure of benz[a]anthracene-dG in ras codon 12,2; GGCAGXTGGTG · the same entry in another collection · chain A against A, TM-score 1.00

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