GL1X · GenesisL1 explorer

MolNFT v1 · #145529 · protein

Sediminispirochaeta smaragdinae sps-1 metallo-beta-lactamase

6CQS: “Sediminispirochaeta smaragdinae sps-1 metallo-beta-lactamase”. X-ray diffraction, 1 ligand (ZN), 1 pocket (best druggability 0.63). MolNFT v1 #145529 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6CQS
Type
protein
Length
242 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-lactamase
EC
3.5.2.6
UniProt
E1R245
Ligands
ZN
Pockets
1 · best druggability 0.63

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABeta-lactamase (EC 3.5.2.6)protein24232% helix, 28% strandE1R245

Ligands and binding sites

  • ZN · Zinc ion · metal · 3 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12230.630.8222ZN

Compared structures

  • 6CQS · Sediminispirochaeta smaragdinae SPS-1 metallo-beta-lactamase · the same entry in another collection · chain A against A, TM-score 1.00

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