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Second bromodomain of CDG4_1340 from cryptosporidium parvum, complexed with bromosporine

Analyse Second bromodomain of CDG4_1340 from cryptosporidium parvum, complexed with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5U9N
Type
protein
Length
245 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Bromo domain containing protein
UniProt
Q5CQB7
Ligands
BMF, SO4
Pockets
1 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 65% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABromo domain containing proteinprotein12564% helix, 0% strandQ5CQB7
BBromo domain containing proteinprotein12067% helix, 0% strandQ5CQB7

Ligands and binding sites

  • BMF · Bromosporine · ligand · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110320.780.8076BMF

Interfaces

1 interface between chains.

  • A–B · 298 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 5U9N · Second Bromodomain of cdg4_1340 from Cryptosporidium parvum, complexed with bromosporine · the same entry in another collection · chain A against A, TM-score 1.00

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