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Crystal structure of apramycin bound to a ribosomal RNA a site oligonucleotide

Analyse Crystal structure of apramycin bound to a ribosomal RNA a site oligonucleotide in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1YRJ
Type
RNA
Length
45 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Bacterial 16 S ribosomal RNA a site oligonucleotide
Ligands
AM2, MG, K
Pockets
1 · best druggability 0.62

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
ABacterial 16 S ribosomal RNA a site oligonucleotiderna23——
BBacterial 16 S ribosomal RNA a site oligonucleotiderna22——

Ligands and binding sites

  • AM2 · Apramycin · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · chains A, B
  • K · Potassium 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
16990.620.7334AM2, MG

Interfaces

1 interface between chains.

  • A–B · 1074 Ų buried · 112 hydrogen bonds · nucleic-nucleic

Compared structures

  • 1YRJ · Crystal Structure of Apramycin bound to a Ribosomal RNA A site oligonucleotide · the same entry in another collection · chain A against A, TM-score 1.00

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