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Staphylococcal aureus ftsz in complex with 723

Analyse Staphylococcal aureus ftsz in complex with 723 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4DXD
Type
protein
Length
307 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cell division protein ftsz
UniProt
P0A031
Ligands
GDP, 9PC
Pockets
3 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACell division protein ftszprotein30745% helix, 24% strandP0A031

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · chains A
  • 9PC · 3-[(6-chloro[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide · ligand · chains A

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

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11940.620.83339PC
22140.580.8041GDP
31020.450.7915empty

Compared structures

  • 4DXD · Staphylococcal Aureus FtsZ in complex with 723 · the same entry in another collection · chain A against A, TM-score 1.00
  • P0A031 · AlphaFold monomer V2.0 prediction for cell division protein ftsz (P0A031) · a predicted model of the same protein · chain A against A, TM-score 0.88

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