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Manganese riboswitch from xanthmonas oryzae bound to MN(II)

Analyse Manganese riboswitch from xanthmonas oryzae bound to MN(II) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6N2V
Type
RNA
Length
198 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
X. oryzae mn riboswitch optimized construct
Ligands
MG, SR, MN, NA
Pockets
8 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BX. oryzae mn riboswitch optimized constructrna99——

Ligands and binding sites

  • MG · Magnesium ion · metal · 39 copies · chains A, B
  • SR · Strontium ion · metal · 9 copies · chains A, B
  • MN · Manganese (II) ion · metal · 7 copies · chains A, B
  • NA · Sodium ion · metal · chains B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17760.660.7540SR, MG
25760.650.7733MG, SR
35240.630.7730MN, NA
44740.620.7727MG, MN, SR
52730.470.7421MG, SR

Interfaces

1 interface between chains.

  • A–B · 307 Ų buried · 4 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 2 modified (nucleotide modification).

Compared structures

  • 6N2V · Manganese riboswitch from Xanthmonas oryzae bound to Mn(II) · the same entry in another collection · chain A against A, TM-score 1.00

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