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Beta-lactamase, unmixed

Analyse Beta-lactamase, unmixed in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7K8L
Type
protein
Length
1,060 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-lactamase
EC
3.5.2.6
UniProt
A0A655AHQ9
Ligands
PO4
Pockets
11 · best druggability 0.67

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DBeta-lactamase (EC 3.5.2.6)protein26541% helix, 17% strandA0A655AHQ9

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 4 copies · chains A, B, C, D

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

Pockets

11 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12900.670.8337PO4
25790.630.7553PO4
31890.620.8428PO4
44700.610.7542PO4
51830.490.7739empty

Interfaces

4 interfaces between chains.

  • A–B · 757 Ų buried · 5 hydrogen bonds · protein-protein
  • C–D · 735 Ų buried · 6 hydrogen bonds · protein-protein
  • B–C · 614 Ų buried · 5 hydrogen bonds · protein-protein
  • A–D · 596 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 7K8L · Beta-lactamase, Unmixed · the same entry in another collection · chain A against A, TM-score 1.00

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