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Crystal structure of 60-mer bfdv capsid protein in complex with single stranded DNA

Analyse Crystal structure of 60-mer bfdv capsid protein in complex with single stranded… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5J37
Type
protein + DNA
Length
1,045 residues
Chains
10
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beak and feather disease virus capsid protein; Single stranded DNA
UniProt
A0A023R6W2
Ligands
PO4
Pockets
20 · best druggability 0.55

Structure

x-ray diffraction · 2 distinct chains · 8% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
E, A, B, C, DBeak and feather disease virus capsid proteinprotein2068% helix, 45% strandA0A023R6W2
F, G, H, I, JSingle stranded DNAdna3——

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 5 copies · chains E, A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1910.550.8521empty
2970.530.8422empty
3900.530.8420empty
4780.530.8520empty
51130.520.8224empty

Interfaces

15 interfaces between chains.

  • B–D · 1061 Ų buried · 20 hydrogen bonds · protein-protein
  • E–B · 1052 Ų buried · 18 hydrogen bonds · protein-protein
  • E–A · 1050 Ų buried · 18 hydrogen bonds · protein-protein
  • C–D · 1041 Ų buried · 19 hydrogen bonds · protein-protein
  • A–C · 1038 Ų buried · 18 hydrogen bonds · protein-protein

Compared structures

  • 5J37 · Crystal structure of 60-mer BFDV Capsid Protein in complex with single stranded DNA · the same entry in another collection · chain E against E, TM-score 1.00

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