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Structure of ndm-metallo-beta-lactamase

Analyse Structure of ndm-metallo-beta-lactamase in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4TZB
Type
protein
Length
231 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Metallo-beta-lactamase
UniProt
G9JVE6
Ligands
NI, ZN, CO, CD
Pockets
1 · best druggability 0.35

Structure

x-ray diffraction · 1 distinct chain · 24% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMetallo-beta-lactamaseprotein23124% helix, 30% strandG9JVE6

Ligands and binding sites

  • NI · Nickel (II) ion · metal · 4 copies · chains A
  • ZN · Zinc ion · metal · chains A
  • CO · Cobalt (II) ion · metal · chains A
  • CD · Cadmium ion · metal · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1920.350.7422CD

Compared structures

  • 4TZB · Structure of NDM-Metallo-beta-lactamase · the same entry in another collection · chain A against A, TM-score 1.00

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