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Crystal structure of a putative pilus assembly-related protein (BPSS2195) from burkholderia pseudomallei K96243 at 2.50 a resolution (psi community target, shapiro L.)

Analyse Crystal structure of a putative pilus assembly-related protein (BPSS2195) from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4DAD
Type
protein
Length
134 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative pilus assembly-related protein
UniProt
Q63I75
Ligands
SO4, CL
Pockets
1 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative pilus assembly-related proteinprotein13444% helix, 20% strandQ63I75

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 3 copies · chains A
  • CL · Chloride ion · ion · 2 copies · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1820.440.8020empty

Modifications

Observed in the structure: 3 modified (engineered).

Compared structures

  • 4DAD · Crystal structure of a Putative pilus assembly-related protein (BPSS2195) from… · the same entry in another collection · chain A against A, TM-score 1.00

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