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Staphylococcus aureus ftsz 12-316 G196S complexed with TXA6101

Analyse Staphylococcus aureus ftsz 12-316 G196S complexed with TXA6101 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5XDV
Type
protein
Length
305 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cell division protein ftsz
UniProt
Q6GHP9
Ligands
GDP, ZI6, CA
Pockets
3 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 46% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACell division protein ftszprotein30546% helix, 23% strandQ6GHP9

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · chains A
  • ZI6 · 3-[[5-bromanyl-4-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]methoxy]-2,6-bis(fluoranyl)benzamide · ligand · chains A
  • CA · Calcium ion · metal · 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
12490.730.8739CA, ZI6
22140.560.7940GDP
31300.490.7916empty

Compared structures

  • 5XDV · Staphylococcus aureus FtsZ 12-316 G196S complexed with TXA6101 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q6GHP9 · AlphaFold monomer V2.0 prediction for cell division protein ftsz (Q6GHP9) · a predicted model of the same protein · chain A against A, TM-score 0.89

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