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MolNFT v1 · #44362 · protein

Solution structure of the bacillus cereus metallo-beta-lactamase bcii

2M5C · Beta-lactamase 2: “Solution structure of the bacillus cereus metallo-beta-lactamase bcii”. Solution nmr, 1 ligand (ZN), 1 pocket (best druggability 0.40). MolNFT v1 #44362 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
2M5C
Type
protein
Length
227 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-lactamase 2
EC
3.5.2.6
UniProt
P04190
Ligands
ZN
Pockets
1 · best druggability 0.40

Structure

solution nmr · 1 distinct chain · 22% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABeta-lactamase 2 (EC 3.5.2.6)protein22722% helix, 22% strandP04190

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · 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
11190.400.7527empty

Compared structures

  • 2M5C · Solution Structure of the Bacillus cereus Metallo-Beta-Lactamase BcII · the same entry in another collection · chain A against A, TM-score 1.00
  • P04190 · AlphaFold monomer V2.0 prediction for metallo-beta-lactamase type 2 (P04190) · a predicted model of the same protein · chain A against A, TM-score 0.94

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