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The binding domain of skn-1 in complex with DNA: a new DNA-binding motif

Analyse The binding domain of skn-1 in complex with DNA: a new DNA-binding motif in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1SKN
Type
protein + DNA
Length
104 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*TP*GP*AP*CP*AP*AP*TP*GP*TP*CP*AP*TP*CP*CP*C)- 3'); DNA…
UniProt
P34707
Pockets
2 · best druggability 0.46

Structure

x-ray diffraction · 3 distinct chains · 73% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA (5'-D(*TP*GP*AP*CP*AP*AP*TP*GP*TP*CP*AP*TP*CP*CP*C)- 3')dna15——
BDNA (5'-D(*CP*AP*GP*GP*GP*AP*TP*GP*AP*CP*AP*TP*TP*GP*T)- 3')dna15——
PDNA-binding domain of skn-1protein7473% helix, 0% strandP34707

Ligands and binding sites

  • LDA · Lauryl dimethylamine-N-oxide · additive · chains P

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
1910.460.8115empty
21340.440.7722empty

Interfaces

3 interfaces between chains.

  • A–B · 603 Ų buried · 65 hydrogen bonds · nucleic-nucleic
  • B–P · 532 Ų buried · 8 hydrogen bonds · protein-nucleic
  • A–P · 401 Ų buried · 7 hydrogen bonds · protein-nucleic

Compared structures

  • 1SKN · The binding domain of skn-1 in complex with DNA: a new DNA-binding motif · the same entry in another collection · chain A against A, TM-score 1.00
  • P34707 · AlphaFold monomer V2.0 prediction for protein skinhead-1 (P34707) · a predicted model of the same protein · chain P against A, TM-score 0.91

Analyse

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