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MolNFT v1 · #117441 · protein

Pseudorabies virus nuclear egress complex, PUL31, PUL34

5E8C: “Pseudorabies virus nuclear egress complex, PUL31, PUL34”. X-ray diffraction, 2 ligands (ZN, CL), 6 pockets (best druggability 0.58). MolNFT v1 #117441 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5E8C
Type
protein
Length
406 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
UL31; UL34 protein
UniProt
G3G955, G3G8R3
Ligands
ZN, CL
Pockets
6 · best druggability 0.58

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUL31protein23845% helix, 21% strandG3G955
BUL34 proteinprotein16825% helix, 30% strandG3G8R3

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12690.580.7839empty
22100.530.7738empty
3950.500.8223empty
41110.450.7819empty
5860.420.7920empty

Interfaces

1 interface between chains.

  • A–B · 1860 Ų buried · 23 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 modified (engineered).

Compared structures

  • 5E8C · pseudorabies virus nuclear egress complex, pUL31, pUL34 · the same entry in another collection · chain A against A, TM-score 1.00

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