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1.95 ångström resolution crystal structure of penicillin binding protein 2X from streptococcus thermophilus

Analyse 1.95 ångström resolution crystal structure of penicillin binding protein 2X… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5U47
Type
protein
Length
684 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Penicillin binding protein 2X
UniProt
Q5M2U8
Ligands
CL
Pockets
6 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 29% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APenicillin binding protein 2Xprotein68429% helix, 26% strandQ5M2U8

Ligands and binding sites

  • CL · Chloride ion · ion · chains A
  • ACT · Acetate ion · additive · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13790.700.8245CL
23750.600.7742empty
32190.530.7732empty
4760.460.8222empty
5810.430.8017empty

Compared structures

  • 5U47 · 1.95 Angstrom Resolution Crystal Structure of Penicillin Binding Protein 2X from… · the same entry in another collection · chain A against A, TM-score 1.00

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