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Crystal structure of H112W mutant of borna disease virus matrix protein

Analyse Crystal structure of H112W mutant of borna disease virus matrix protein in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4HIT
Type
protein
Length
522 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Matrix protein
UniProt
P0C794
Ligands
SO4, CL
Pockets
5 · best druggability 0.63

Structure

x-ray diffraction · 3 distinct chains · 22% helix, 36% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DMatrix proteinprotein13522% helix, 35% strandP0C794
CMatrix proteinprotein12421% helix, 37% strandP0C794
BMatrix proteinprotein12823% helix, 38% strandP0C794

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 9 copies · chains A, B, D, C
  • CL · Chloride ion · ion · 2 copies · chains A, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13670.630.7857SO4
2760.410.7920empty
31000.390.7616empty
4540.320.7716empty
5520.290.7615SO4

Interfaces

5 interfaces between chains.

  • A–B · 1173 Ų buried · 14 hydrogen bonds · protein-protein
  • D–C · 1108 Ų buried · 13 hydrogen bonds · protein-protein
  • A–D · 1108 Ų buried · 17 hydrogen bonds · protein-protein
  • C–B · 992 Ų buried · 13 hydrogen bonds · protein-protein
  • D–B · 37 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 4HIT · Crystal structure of H112W mutant of borna disease virus matrix protein · the same entry in another collection · chain A against A, TM-score 1.00

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