Research workbench
Duplex [5'-D(GCGTA+TACGC)]2 with incorporated 2'-O-methyl- [TRI(OXYETHYL)] ribonucleoside
Analyse Duplex [5'-D(GCGTA+TACGC)]2 with incorporated 2'-O-methyl- [TRI(OXYETHYL)]… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 412D
- Type
- DNA
- Length
- 20 nucleotides
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- DNA (5'-D(*GP*CP*GP*TP*AP*(126)P*AP*CP*GP*C)-3')
- Ligands
- MG
- Pockets
- 1 · best druggability 0.25
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | DNA (5'-D(*GP*CP*GP*TP*AP*(126)P*AP*CP*GP*C)-3') | dna | 10 | — | — |
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.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 70 | 0.25 | 0.71 | 12 | MG |
Interfaces
1 interface between chains.
- A–B · 489 Ų buried · 46 hydrogen bonds · nucleic-nucleic
Modifications
Observed in the structure: 2 modified (nucleotide modification).
Compared structures
- 412D · Duplex [5'-D(GCGTA+TACGC)]2 with incorporated 2'-O-methyl-[TRI(OXYETHYL)] ribonucleoside · the same entry in another collection · chain B against B, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Elsewhere: RCSB PDB 412D · PDBe 412D
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