MolNFT v1 · #12682 · RNA
RNA aptamer complexed with citrulline, NMR
1KOD · RNA (5'-R(P*AP*GP*AP*AP*GP*GP*AP*GP*UP*GP*U)-3'): “RNA aptamer complexed with citrulline, NMR”. Solution nmr, 1 ligand (CIR), 1 pocket (best druggability 0.44). MolNFT v1 #12682 on GenesisL1: 3D structure, binding sites and pockets…
- PDB
- 1KOD
- Type
- RNA
- Length
- 25 nucleotides
- Chains
- 2
- Method
- solution nmr
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- RNA (5'-R(P*AP*GP*AP*AP*GP*GP*AP*GP*UP*GP*U)-3'); RNA…
- Ligands
- CIR
- Pockets
- 1 · best druggability 0.44
Structure
solution nmr · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | RNA (5'-R(P*AP*GP*AP*AP*GP*GP*AP*GP*UP*GP*U)-3') | rna | 11 | — | — |
| B | RNA (5'-R(P*AP*CP*GP*GP*UP*UP*AP*GP*GP*UP*CP*GP*CP*U)-3') | rna | 14 | — | — |
Ligands and binding sites
- CIR · Citrulline · ligand · 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 | 148 | 0.44 | 0.77 | 15 | empty |
Interfaces
1 interface between chains.
- A–B · 570 Ų buried · 53 hydrogen bonds · nucleic-nucleic
Compared structures
- 1KOD · RNA aptamer complexed with citrulline, NMR · the same entry in another collection · chain A against A, 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 1KOD · PDBe 1KOD
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