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MolNFT v1 · #64050 · RNA

Class II ligase ribozyme product-template duplex, structure 2

3FS0 · 5'-R(*GP*GP*UP*GP*AP*GP*GP*CP*UP*G)-3': “Class II ligase ribozyme product-template duplex, structure 2”. X-ray diffraction, 1 ligand (MG), 1 pocket (best druggability 0.23). MolNFT v1 #64050 on GenesisL1: 3D structure, binding sites…

PDB
3FS0
Type
RNA
Length
21 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-R(*GP*GP*UP*GP*AP*GP*GP*CP*UP*G)-3'; 5'-R(*CP*CP*AP*GP*UP*CP*GP*GP*AP*AP*C)-3'
Ligands
MG
Pockets
1 · best druggability 0.23

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'-R(*GP*GP*UP*GP*AP*GP*GP*CP*UP*G)-3'rna10——
B5'-R(*CP*CP*AP*GP*UP*CP*GP*GP*AP*AP*C)-3'rna11——

Ligands and binding sites

  • MG · Magnesium ion · metal · 5 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1570.230.7212empty

Interfaces

1 interface between chains.

  • A–B · 545 Ų buried · 41 hydrogen bonds · nucleic-nucleic

Compared structures

  • 3FS0 · Class II ligase ribozyme product-template duplex, structure 2 · the same entry in another collection · chain A against A, TM-score 1.00

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