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Crystal structure of product bound cell shape determinant protein CSD4 from helicobacter pylori

Analyse Crystal structure of product bound cell shape determinant protein CSD4 from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4WCL
Type
protein
Length
416 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Conserved hypothetical secreted protein
UniProt
B5ZAD9
Ligands
API, ZN, NA, IOD
Pockets
4 · best druggability 0.53

Structure

x-ray diffraction · 1 distinct chain · 25% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AConserved hypothetical secreted proteinprotein41625% helix, 33% strandB5ZAD9

Ligands and binding sites

  • API · 2,6-diaminopimelic acid · ligand · chains A
  • ZN · Zinc ion · metal · 3 copies · chains A
  • NA · Sodium ion · metal · chains A
  • IOD · Iodide ion · ion · 31 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11060.530.8325API
2910.360.7417IOD
3670.330.7616empty
4710.320.7516IOD

Compared structures

  • 4WCL · Crystal Structure of product bound Cell Shape Determinant protein Csd4 from Helicobacter… · the same entry in another collection · chain A against A, TM-score 1.00

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