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MolNFT v1 · #84213 · protein

Tetramerization domain of measles virus phosphoprotein

3ZDO: “Tetramerization domain of measles virus phosphoprotein”. X-ray diffraction, 3 pockets (best druggability 0.59). MolNFT v1 #84213 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3ZDO
Type
protein
Length
505 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoprotein
UniProt
Q83623
Pockets
3 · best druggability 0.59

Structure

x-ray diffraction · 5 distinct chains · 96% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoproteinprotein6395% helix, 0% strandQ83623
B, E, HPhosphoproteinprotein6297% helix, 0% strandQ83623
CPhosphoproteinprotein6397% helix, 0% strandQ83623
D, GPhosphoproteinprotein6494% helix, 0% strandQ83623
FPhosphoproteinprotein6595% helix, 0% strandQ83623

Ligands and binding sites

  • MRD · (4R)-2-methylpentane-2,4-diol · additive · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11870.590.8120MRD
21070.450.7916empty
3920.420.7820empty

Interfaces

20 interfaces between chains.

  • E–F · 1609 Ų buried · 14 hydrogen bonds · protein-protein
  • A–D · 1588 Ų buried · 13 hydrogen bonds · protein-protein
  • B–C · 1545 Ų buried · 12 hydrogen bonds · protein-protein
  • G–H · 1528 Ų buried · 15 hydrogen bonds · protein-protein
  • F–G · 1484 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 3ZDO · Tetramerization domain of Measles virus phosphoprotein · the same entry in another collection · chain A against A, TM-score 1.00

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