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MolNFT v1 · #63214 · RNA

Crystal structure of the FMN riboswitch bound to FMN, cs+ soak.

3F2X: “Crystal structure of the FMN riboswitch bound to FMN, cs+ soak.”. X-ray diffraction, 3 ligands (FMN, MG, CS), 6 pockets (best druggability 0.74). MolNFT v1 #63214 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3F2X
Type
RNA
Length
109 nucleotides
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
FMN riboswitch
Ligands
FMN, MG, CS
Pockets
6 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
XFMN riboswitchrna109——

Ligands and binding sites

  • FMN · Flavin mononucleotide · ligand · chains X
  • MG · Magnesium ion · metal · 13 copies · chains X
  • CS · Cesium ion · metal · 4 copies · chains X

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18300.740.8043FMN, MG, CS
21270.440.7816empty
31270.360.7314MG
4580.300.769CS
5550.290.7614MG

Modifications

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

Compared structures

  • 3F2X · Crystal structure of the FMN riboswitch bound to FMN, Cs+ soak. · the same entry in another collection · chain X against X, TM-score 1.00

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