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Structure of 3'-fluoro cyclohexenyl nucleic acid decamer

Analyse Structure of 3'-fluoro cyclohexenyl nucleic acid decamer in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4F2Y
Type
DNA
Length
20 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*GP*CP*GP*TP*AP*(XTF)P*AP*CP*GP*C)-3'
Ligands
MG
Pockets
1 · best druggability 0.32

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B5'-D(*GP*CP*GP*TP*AP*(XTF)P*AP*CP*GP*C)-3'dna10——

Ligands and binding sites

  • MG · Magnesium ion · metal · 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
11040.320.7213MG

Interfaces

1 interface between chains.

  • A–B · 491 Ų buried · 46 hydrogen bonds · nucleic-nucleic

Modifications

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

Compared structures

  • 4F2Y · Structure of 3'-Fluoro Cyclohexenyl Nucleic Acid Decamer · the same entry in another collection · chain A against A, TM-score 1.00

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