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MolNFT v1 · #13214 · DNA

Holliday junction tcggtaccga with na and ca binding sites.

1L4J · 5'-D(*TP*CP*GP*GP*TP*AP*CP*CP*GP*A)-3': “Holliday junction tcggtaccga with na and ca binding sites.”. X-ray diffraction, 2 ligands (CA, NA), 2 pockets (best druggability 0.46). MolNFT v1 #13214 on GenesisL1: 3D structure, binding…

PDB
1L4J
Type
DNA
Length
40 nucleotides
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*TP*CP*GP*GP*TP*AP*CP*CP*GP*A)-3'
Ligands
CA, NA
Pockets
2 · best druggability 0.46

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D5'-D(*TP*CP*GP*GP*TP*AP*CP*CP*GP*A)-3'dna10——

Ligands and binding sites

  • CA · Calcium ion · metal · 4 copies · chains A, D, B, C
  • NA · Sodium ion · metal · 2 copies · chains C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12490.460.7320NA
22500.450.7321empty

Interfaces

6 interfaces between chains.

  • C–D · 308 Ų buried · 23 hydrogen bonds · nucleic-nucleic
  • A–B · 304 Ų buried · 25 hydrogen bonds · nucleic-nucleic
  • A–D · 224 Ų buried · 17 hydrogen bonds · nucleic-nucleic
  • B–D · 223 Ų buried · 1 hydrogen bond · nucleic-nucleic
  • B–C · 212 Ų buried · 16 hydrogen bonds · nucleic-nucleic

Compared structures

  • 1L4J · Holliday Junction TCGGTACCGA with Na and Ca Binding Sites. · the same entry in another collection · chain A against A, TM-score 1.00

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