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The crystal structure of an all-RNA minimal hairpin ribozyme with mutant G8I at the cleavage site

Analyse The crystal structure of an all-RNA minimal hairpin ribozyme with mutant G8I at… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1ZFT
Type
RNA
Length
61 nucleotides
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-R(*UP*CP*CP*CP*(A2M)P*GP*UP*CP*CP*AP*CP*CP*G)-3'…
Ligands
NCO, SO4
Pockets
3 · best druggability 0.41

Structure

x-ray diffraction · 4 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A5'-R(*UP*CP*CP*CP*(A2M)P*GP*UP*CP*CP*AP*CP*CP*G)-3'rna13——
B5'-R(*CP*GP*GP*UP*GP*AP*IP*AP*AP*GP*GP*G)-3'rna12——
C5'-R(*GP*GP*CP*AP*GP*AP*GP*AP*AP*AP*CP*AP*CP*AP*CP*GP*A)- 3'rna17——
D5'-R(*UP*CP*GP*UP*GP*GP*UP*AP*CP*AP*UP*UP*AP*CP*CP*UP*GP*CP *C)-3'rna19——

Ligands and binding sites

  • NCO · Cobalt hexammine(iii) · ligand · 2 copies · chains A, B, C, D
  • SO4 · Sulfate ion · ion · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11830.410.7316empty
21380.380.7417empty
31500.380.7317empty

Interfaces

6 interfaces between chains.

  • C–D · 894 Ų buried · 76 hydrogen bonds · nucleic-nucleic
  • A–B · 669 Ų buried · 49 hydrogen bonds · nucleic-nucleic
  • A–D · 347 Ų buried · 7 hydrogen bonds · nucleic-nucleic
  • B–C · 207 Ų buried · 8 hydrogen bonds · nucleic-nucleic
  • A–C · 175 Ų buried · 5 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 1 modified (nucleotide modification).

Compared structures

  • 1ZFT · The crystal structure of an all-RNA minimal Hairpin Ribozyme with mutant G8I at the… · the same entry in another collection · chain A against A, TM-score 1.00

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