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MolNFT v1 · #136711 · RNA

Structure of R-gna dodecamer

5V1K · RNA (5'-R(*CP*GP*CP*GP*AP*AP*(5BU)P*(8RJ)P*AP*GP*CP*G)-3'): “Structure of R-gna dodecamer”. X-ray diffraction, 1 ligand (8RJ), 1 pocket (best druggability 0.27). MolNFT v1 #136711 on GenesisL1: 3D structure, binding sites and…

PDB
5V1K
Type
RNA
Length
22 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (5'-R(*CP*GP*CP*GP*AP*AP*(5BU)P*(8RJ)P*AP*GP*CP*G)-3')
Ligands
8RJ
Pockets
1 · best druggability 0.27

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BRNA (5'-R(*CP*GP*CP*GP*AP*AP*(5BU)P*(8RJ)P*AP*GP*CP*G)-3')rna11——

Ligands and binding sites

  • 8RJ · (R)-1'-(2',3'-dihydroxypropyl)-thymine · ligand · 2 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
1500.270.759empty

Interfaces

1 interface between chains.

  • A–B · 681 Ų buried · 54 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 4 covalent, 2 modified (covalent ligand, nucleotide modification).

Compared structures

  • 5V1K · Structure of R-GNA dodecamer · the same entry in another collection · chain A against A, TM-score 1.00

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