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MolNFT v1 · #66570 · protein

Structures of spop-substrate complexes: insights into molecular architectures of btb-CUL3 ubiquitin ligases: SPOPMATHX/BTB/3-box- PUCSBC1

3HU6 · Speckle-type poz protein: “Structures of spop-substrate complexes: insights into molecular architectures of btb-CUL3 ubiquitin ligases…”. X-ray diffraction, 4 pockets (best druggability 0.52). MolNFT v1 #66570 on GenesisL1: 3D…

PDB
3HU6
Type
protein
Length
578 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Speckle-type poz protein; Puckered
EC
3.1.3.-, 3.1.3.16, 3.1.3.48
UniProt
O43791, Q9VHV8
Pockets
4 · best druggability 0.52

Structure

x-ray diffraction · 3 distinct chains · 35% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASpeckle-type poz proteinprotein28435% helix, 29% strandO43791
BSpeckle-type poz proteinprotein28236% helix, 30% strandO43791
C, DPuckered (EC 3.1.3.-, 3.1.3.16, 3.1.3.48)protein60% helix, 17% strandQ9VHV8

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12020.520.7727empty
22990.500.7332empty
31300.410.7418empty
4740.330.7514empty

Interfaces

3 interfaces between chains.

  • A–B · 2229 Ų buried · 29 hydrogen bonds · protein-protein
  • B–D · 381 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 361 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 3HU6 · Structures of SPOP-Substrate Complexes: Insights into Molecular Architectures of BTB-Cul3… · the same entry in another collection · chain A against A, TM-score 1.00
  • O43791 · AlphaFold monomer V2.0 prediction for speckle-type poz protein (O43791) · a predicted model of the same protein · chain A against A, TM-score 0.82

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