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Zinc finger domain of WT1(-kts form) with 13+1MER oligonucleotide with 3' triplet tgt

Analyse Zinc finger domain of WT1(-kts form) with 13+1MER oligonucleotide with 3'… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6B0Q
Type
protein + DNA
Length
289 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Wilms tumor protein; DNA (5'-D(P*GP*CP*GP*TP*GP*GP*GP*AP*GP*TP*GP*TP*T)-3'); DNA…
UniProt
P19544
Ligands
ZN, SO4
Pockets
7 · best druggability 0.72

Structure

x-ray diffraction · 4 distinct chains · 35% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
DWilms tumor proteinprotein11835% helix, 14% strandP19544
E, BDNA (5'-D(P*GP*CP*GP*TP*GP*GP*GP*AP*GP*TP*GP*TP*T)-3')dna13——
F, CDNA (5'-D(P*AP*AP*CP*AP*CP*TP*CP*CP*CP*AP*CP*GP*C)-3')dna13——
AWilms tumor proteinprotein11935% helix, 14% strandP19544

Ligands and binding sites

  • ZN · Zinc ion · metal · 8 copies · chains D, A
  • SO4 · Sulfate ion · ion · 8 copies · chains D, E, A, B

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

Pockets

7 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1960.720.9423empty
21360.690.9026empty
3930.650.9118empty
4730.640.9216empty
5570.320.7715empty

Interfaces

9 interfaces between chains.

  • A–B · 1018 Ų buried · 21 hydrogen bonds · protein-nucleic
  • D–E · 954 Ų buried · 22 hydrogen bonds · protein-nucleic
  • D–F · 631 Ų buried · 7 hydrogen bonds · protein-nucleic
  • E–F · 588 Ų buried · 40 hydrogen bonds · nucleic-nucleic
  • B–C · 582 Ų buried · 42 hydrogen bonds · nucleic-nucleic

Compared structures

  • 6B0Q · Zinc finger Domain of WT1(-KTS form) with 13+1mer Oligonucleotide with 3' Triplet TGT · the same entry in another collection · chain C against C, TM-score 1.00
  • P19544 · AlphaFold monomer V2.0 prediction for wilms tumor protein (P19544) · a predicted model of the same protein · chain A against A, TM-score 0.81

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