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MolNFT v1 · #137026 · DNA

Sulfur as a bromine biomolecular halogen-bond acceptor

5VBJ · DNA (5'-D(*CP*CP*GP*AP*TP*(AS)P*(BRU)P*CP*GP*G)-3'): “Sulfur as a bromine biomolecular halogen-bond acceptor”. X-ray diffraction, 1 ligand (CA). MolNFT v1 #137026 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5VBJ
Type
DNA
Length
20 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*CP*CP*GP*AP*TP*(AS)P*(BRU)P*CP*GP*G)-3')
Ligands
CA

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BDNA (5'-D(*CP*CP*GP*AP*TP*(AS)P*(BRU)P*CP*GP*G)-3')dna10——

Ligands and binding sites

  • CA · Calcium ion · metal · chains B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Interfaces

1 interface between chains.

  • A–B · 299 Ų buried · 28 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 4 modified (nucleotide modification).

Compared structures

  • 5VBJ · Sulfur as a bromine biomolecular halogen-bond acceptor · the same entry in another collection · chain A against A, TM-score 1.00

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