MolNFT v1 · #23256 · DNA

NMR structure analysis of the B-DNA dodecamer ctctcacgtggag with a tricyclic cytosin base analogue

1TUQ · 5'-D(P*CP*TP*CP*(TC1)P*AP*CP*GP*TP*GP*GP*AP*G)-3': “NMR structure analysis of the B-DNA dodecamer ctctcacgtggag with a tricyclic cytosin base analogue”. Solution nmr, 1 pocket (best druggability 0.25). MolNFT v1 #23256 on GenesisL1…

PDB: 1TUQ
Type: DNA
Length: 24 nucleotides
Chains: 2
Method: solution nmr
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: 5'-D(P*CP*TP*CP*(TC1)P*AP*CP*GP*TP*GP*GP*AP*G)-3'
Pockets: 1 · best druggability 0.25

Structure

solution nmr · 1 distinct chain.

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A, B	5'-D(PCPTPCP(TC1)PAPCPGPTPGPGPAPG)-3'	dna	12	—	—

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	60	0.25	0.71	8	empty

Interfaces

1 interface between chains.

A–B · 605 Å² buried · 68 hydrogen bonds · nucleic-nucleic

Modifications

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

Compared structures

1TUQ · NMR Structure Analysis of the B-DNA Dodecamer CTCtCACGTGGAG with a tricyclic cytosin base… · 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 1TUQ · PDBe 1TUQ

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