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MolNFT v1 · #23049 · RNA

Saccharide-RNA recognition in an aminoglycoside antibiotic-RNA aptamer complex, NMR, 7 structures

1TOB · RNA (5'-R(GGCACGAGGUUUAGCUACACUCGUGCC)-3'): “Saccharide-RNA recognition in an aminoglycoside antibiotic-RNA aptamer complex, NMR, 7 structures”. Solution nmr, 3 ligands (TOA, TOC, TOB), 1 pocket (best druggability 0.32). MolNFT v1…

PDB
1TOB
Type
RNA
Length
27 nucleotides
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (5'-R(GGCACGAGGUUUAGCUACACUCGUGCC)-3')
Ligands
TOA, TOC, TOB
Pockets
1 · best druggability 0.32

Structure

solution nmr · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
ARNA (5'-R(GGCACGAGGUUUAGCUACACUCGUGCC)-3')rna27——

Ligands and binding sites

  • TOA · 3-ammonio-3-deoxy-alpha-D-glucopyranose · ligand · chains A
  • TOC · 2,6-diammonio-2,3,6-trideoxy-alpha-D-glucopyranose · ligand · chains A
  • TOB · 1,3-diamino-5,6-dihydroxycyclohexane · ligand · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1870.320.7412TOA, TOB

Compared structures

  • 1TOB · Saccharide-RNA recognition in an aminoglycoside antibiotic-RNA aptamer complex, NMR, 7… · the same entry in another collection · chain A against A, TM-score 1.00

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