MolNFT v1 · #1312 · DNA
Solution NMR structure of the [BP]DA adduct opposite dt in a DNA duplex, 6 structures
1AXV · DNA duplex D(CTCTC-[BP]A-CTTCC)D(GGAAGTGAGAG): “Solution NMR structure of the [BP]DA adduct opposite dt in a DNA duplex, 6 structures”. Solution nmr, 1 ligand (BAP). MolNFT v1 #1312 on GenesisL1: 3D structure, binding sites and…
- PDB
- 1AXV
- Type
- DNA
- Length
- 22 nucleotides
- Chains
- 2
- Method
- solution nmr
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- DNA duplex D(CTCTC-[BP]A-CTTCC)D(GGAAGTGAGAG)
- Ligands
- BAP
Structure
solution nmr · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | DNA duplex D(CTCTC-[BP]A-CTTCC)D(GGAAGTGAGAG) | dna | 11 | — | — |
| B | DNA duplex D(CTCTC-[BP]A-CTTCC)D(GGAAGTGAGAG) | dna | 11 | — | — |
Ligands and binding sites
- BAP · 1,2,3-trihydroxy-1,2,3,4-tetrahydrobenzo[a]pyrene · ligand · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Interfaces
1 interface between chains.
- A–B · 494 Ų buried · 55 hydrogen bonds · nucleic-nucleic
Modifications
Observed in the structure: 1 covalent (covalent ligand).
Compared structures
- 1AXV · Solution NMR structure of the [BP]DA adduct opposite dt in a DNA duplex, 6 structures · 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 1AXV · PDBe 1AXV
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