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2.9 a crystal structure of streptomycin RNA-aptamer complex

Analyse 2.9 a crystal structure of streptomycin RNA-aptamer complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1NTB
Type
RNA
Length
40 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'- R(*GP*GP*AP*UP*CP*GP*CP*AP*UP*UP*UP*GP*GP*AP*CP*UP*UP*CP*UP *GP*CP*C)-3'; 5'…
Ligands
SRY, NA, MG
Pockets
2 · best druggability 0.50

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'- R(*GP*GP*AP*UP*CP*GP*CP*AP*UP*UP*UP*GP*GP*AP*CP*UP*UP*CP*UP *GP*CP*C)-3'rna22——
B5'- R(*CP*GP*GP*CP*AP*CP*CP*AP*CP*GP*GP*UP*CP*GP*GP*AP*UP*C)- 3'rna18——

Ligands and binding sites

  • SRY · Streptomycin · ligand · chains A, B
  • NA · Sodium ion · metal · 2 copies · chains A
  • MG · Magnesium ion · metal · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12180.500.7616empty
2540.420.8415SRY

Interfaces

1 interface between chains.

  • A–B · 1091 Ų buried · 98 hydrogen bonds · nucleic-nucleic

Compared structures

  • 1NTB · 2.9 A crystal structure of Streptomycin RNA-aptamer complex · the same entry in another collection · chain A against A, TM-score 1.00

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