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NMR structure of a kissing complex formed between the tar RNA element of HIV-1 and a lna modified aptamer

Analyse NMR structure of a kissing complex formed between the tar RNA element of HIV-1… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2PN9
Type
RNA
Length
32 nucleotides
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'- R(*GP*GP*AP*GP*CP*CP*UP*GP*GP*GP*AP*GP*CP*UP*CP*C)-3'; RNA 16-mer with locked…
Pockets
1 · best druggability 0.66

Structure

solution nmr · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'- R(*GP*GP*AP*GP*CP*CP*UP*GP*GP*GP*AP*GP*CP*UP*CP*C)-3'rna16——
BRNA 16-mer with locked residues 9-10rna16——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15080.660.7823empty

Interfaces

1 interface between chains.

  • A–B · 411 Ų buried · 31 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 2 modified (nucleotide modification).

Compared structures

  • 2PN9 · NMR structure of a kissing complex formed between the TAR RNA element of HIV-1 and a LNA… · the same entry in another collection · chain A against A, TM-score 1.00

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