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MolNFT v1 · #128956 · RNA

The structure of the thermobifida fusca guanidine III riboswitch with 1-ethylguanidine.

5O62 · RNA (41-mer): “The structure of the thermobifida fusca guanidine III riboswitch with 1-ethylguanidine.”. X-ray diffraction, 2 ligands (EGD, MG), 3 pockets (best druggability 0.54). MolNFT v1 #128956 on GenesisL1: 3D structure…

PDB
5O62
Type
RNA
Length
74 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (41-mer)
Ligands
EGD, MG
Pockets
3 · best druggability 0.54

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
ARNA (41-mer)rna41——
BRNA (41-mer)rna33——

Ligands and binding sites

  • EGD · N-ethylguanidine · ligand · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11650.540.8113empty
21480.490.7912EGD
3700.290.759empty

Modifications

Observed in the structure: 4 modified (nucleotide modification).

Compared structures

  • 5O62 · The structure of the thermobifida fusca guanidine III riboswitch with 1-Ethylguanidine. · the same entry in another collection · chain A against A, TM-score 1.00

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