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Crystal structure of the UAF1/WDR20/USP12 complex

Analyse Crystal structure of the UAF1/WDR20/USP12 complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5K1C
Type
protein
Length
1,224 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ubiquitin carboxyl-terminal hydrolase 12; Wd repeat-containing protein 48; Wd…
EC
3.4.19.12
UniProt
O75317, Q8TAF3, Q8TBZ3
Ligands
TAM, ZN, PO4
Pockets
13 · best druggability 0.83

Structure

x-ray diffraction · 3 distinct chains · 12% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUbiquitin carboxyl-terminal hydrolase 12 (EC 3.4.19.12)protein30227% helix, 30% strandO75317
BWd repeat-containing protein 48protein51510% helix, 37% strandQ8TAF3
CWd repeat-containing protein 20protein4072% helix, 45% strandQ8TBZ3

Ligands and binding sites

  • TAM · Tris(hydroxyethyl)aminomethane · ligand · chains C
  • ZN · Zinc ion · metal · chains A
  • PO4 · Phosphate ion · ion · chains B

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

Pockets

13 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110450.830.8493empty
27050.810.8557empty
39610.770.7996empty
44010.700.8247empty
52490.690.8444empty

Interfaces

3 interfaces between chains.

  • A–C · 1127 Ų buried · 20 hydrogen bonds · protein-protein
  • A–B · 758 Ų buried · 17 hydrogen bonds · protein-protein
  • B–C · 416 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 5K1C · Crystal structure of the UAF1/WDR20/USP12 complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8TAF3 · AlphaFold monomer V2.0 prediction for wd repeat-containing protein 48 (Q8TAF3) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • Q8TBZ3 · AlphaFold monomer V2.0 prediction for wd repeat-containing protein 20 (Q8TBZ3) · a predicted model of the same protein · chain C against A, TM-score 0.97
  • O75317 · AlphaFold monomer V2.0 prediction for ubiquitin carboxyl-terminal hydrolase 12 (O75317) · a predicted model of the same protein · chain A against A, TM-score 0.93

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