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MolNFT v1 · #108624 · protein

Crystal structure of apo cell shape determinant protein CSD4 from helicobacter pylori

4WCK · Conserved hypothetical secreted protein: “Crystal structure of apo cell shape determinant protein CSD4 from helicobacter pylori”. X-ray diffraction, 2 ligands (API, IOD), 4 pockets (best druggability 0.55). MolNFT v1 #108624 on…

PDB
4WCK
Type
protein
Length
420 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Conserved hypothetical secreted protein
UniProt
B5ZAD9
Ligands
API, IOD
Pockets
4 · best druggability 0.55

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
AConserved hypothetical secreted proteinprotein42025% helix, 33% strandB5ZAD9

Ligands and binding sites

  • API · 2,6-diaminopimelic acid · ligand · chains A
  • IOD · Iodide ion · ion · 32 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
11340.550.8228IOD, API
21790.470.7632IOD
31490.460.7626IOD
4670.330.7516empty

Compared structures

  • 4WCK · Crystal Structure of apo Cell Shape Determinant protein Csd4 from Helicobacter pylori · the same entry in another collection · chain A against A, TM-score 1.00

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