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BT_4244 metallopeptidase in complex with tn antigen.

Analyse BT_4244 metallopeptidase in complex with tn antigen. in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5KD8
Type
protein
Length
537 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Metallopeptidase
UniProt
Q89ZX7
Ligands
SER, A2G, NI, NA, ZN
Pockets
4 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMetallopeptidaseprotein53734% helix, 22% strandQ89ZX7

Ligands and binding sites

  • SER · Serine · ligand · chains A
  • A2G · 2-acetamido-2-deoxy-alpha-D-galactopyranose · sugar · chains A
  • NI · Nickel (II) ion · metal · 2 copies · chains A
  • NA · Sodium ion · metal · 2 copies · chains A
  • ZN · Zinc ion · metal · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11430.440.7620NA
2700.320.7522empty
3530.300.7512empty
4580.290.7414empty

Compared structures

  • 5KD8 · BT_4244 metallopeptidase in complex with Tn antigen. · the same entry in another collection · chain A against A, TM-score 1.00

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