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Crystal structure of an empty vesicular stomatitis virus nucleocapsid protein complex

Analyse Crystal structure of an empty vesicular stomatitis virus nucleocapsid protein… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3PTO
Type
protein
Length
2,075 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nucleoprotein
UniProt
P03521
Ligands
IUM
Pockets
20 · best druggability 0.72

Structure

x-ray diffraction · 5 distinct chains · 42% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANucleoproteinprotein41642% helix, 5% strandP03521
BNucleoproteinprotein41542% helix, 6% strandP03521
CNucleoproteinprotein41342% helix, 6% strandP03521
DNucleoproteinprotein41643% helix, 6% strandP03521
ENucleoproteinprotein41542% helix, 5% strandP03521

Ligands and binding sites

  • IUM · Uranyl (VI) ion · metal · 15 copies · chains A, B, C, D, E

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14300.720.8246empty
23990.710.8244empty
311000.680.73116empty
42010.670.8621empty
51690.670.8720empty

Interfaces

7 interfaces between chains.

  • C–D · 2626 Ų buried · 26 hydrogen bonds · protein-protein
  • A–E · 2609 Ų buried · 28 hydrogen bonds · protein-protein
  • B–C · 2565 Ų buried · 33 hydrogen bonds · protein-protein
  • A–B · 2548 Ų buried · 27 hydrogen bonds · protein-protein
  • B–D · 350 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 3PTO · Crystal Structure of an empty Vesicular Stomatitis Virus Nucleocapsid Protein Complex · the same entry in another collection · chain A against A, TM-score 1.00

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