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Crystal structure and improved antisense properties of 2'-O-(2- methoxyethyl)-RNA

Analyse Crystal structure and improved antisense properties of 2'-O-(2… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
469D
Type
RNA
Length
24 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (5'-R(*(C43)P*(G48)P*(C43)P*(G48)P*(A44)P*(A44)P*(U36)…
Ligands
MG
Pockets
1 · best druggability 0.57

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BRNA (5'-R(*(C43)P*(G48)P*(C43)P*(G48)P*(A44)P*(A44)P*(U36) P*(U36)P*(C43)P*(G48)P*(C43)P*(G48))-3')rna12——

Ligands and binding sites

  • MG · Magnesium ion · metal · chains A, B

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14070.570.7522empty

Interfaces

1 interface between chains.

  • A–B · 753 Ų buried · 63 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 24 modified (nucleotide modification).

Compared structures

  • 469D · Crystal structure and improved antisense properties of 2'-O-(2-methoxyethyl)-RNA · the same entry in another collection · chain A against A, TM-score 1.00

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