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MolNFT v1 · #140020 · protein

Crystal structure of POZ1 and TPZ1

5XXE · Protection of telomeres protein POZ1: “Crystal structure of POZ1 and TPZ1”. X-ray diffraction, 2 ligands (ZN, SO4), 6 pockets (best druggability 0.36). MolNFT v1 #140020 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5XXE
Type
protein
Length
509 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protection of telomeres protein POZ1; Protection of telomeres protein TPZ1
UniProt
O13852, O14246
Ligands
ZN, SO4
Pockets
6 · best druggability 0.36

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtection of telomeres protein POZ1protein22073% helix, 0% strandO13852
C, DProtection of telomeres protein TPZ1protein3272% helix, 0% strandO14246
BProtection of telomeres protein POZ1protein22574% helix, 0% strandO13852

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, C, B, D
  • SO4 · Sulfate ion · ion · 10 copies · chains A, C, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1880.360.7518empty
2890.360.7516SO4
3670.350.7715empty
4550.310.7613empty
5610.290.7414empty

Interfaces

3 interfaces between chains.

  • A–C · 1267 Ų buried · 15 hydrogen bonds · protein-protein
  • B–D · 1265 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 755 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 20 modified (engineered).

Compared structures

  • 5XXE · Crystal structure of Poz1 and Tpz1 · the same entry in another collection · chain A against A, TM-score 1.00
  • O13852 · AlphaFold monomer V2.0 prediction for protection of telomeres protein POZ1 (O13852) · a predicted model of the same protein · chain B against A, TM-score 0.96
  • O14246 · AlphaFold monomer V2.0 prediction for protection of telomeres protein TPZ1 (O14246) · a predicted model of the same protein · chain C against A, TM-score 0.61

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