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MolNFT v1 · #65444 · RNA

Crystal structure of the T. tengcongensis SAM-I riboswitch variant U34C/A94G bound with SAM in manganese chloride

3GX6 · RNA (94-mer): “Crystal structure of the T. tengcongensis SAM-I riboswitch variant U34C/A94G bound with SAM in manganese…”. X-ray diffraction, 2 ligands (SAM, MN), 4 pockets (best druggability 0.75). MolNFT v1 #65444 on GenesisL1: 3D…

PDB
3GX6
Type
RNA
Length
94 nucleotides
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (94-mer)
Ligands
SAM, MN
Pockets
4 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
ARNA (94-mer)rna94——

Ligands and binding sites

  • SAM · S-adenosylmethionine · ligand · chains A
  • MN · Manganese (II) ion · metal · 5 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110790.750.7944SAM, MN
24100.590.7622empty
32610.490.7517empty
4760.280.739MN

Compared structures

  • 3GX6 · Crystal structure of the T. tengcongensis SAM-I riboswitch variant U34C/A94G bound with… · the same entry in another collection · chain A against A, TM-score 1.00

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