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MolNFT v1 · #186165 · protein

Crystal structure of ctx-M-15 G238C/A240 insert mutant apoenzyme

7R3Q · Beta-lactamase: “Crystal structure of ctx-M-15 G238C/A240 insert mutant apoenzyme”. X-ray diffraction, 2 ligands (SO4, CL), 1 pocket (best druggability 0.30). MolNFT v1 #186165 on GenesisL1: 3D structure, binding sites and pockets…

PDB
7R3Q
Type
protein
Length
263 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-lactamase
EC
3.5.2.6
UniProt
G3G192
Ligands
SO4, CL
Pockets
1 · best druggability 0.30

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABeta-lactamase (EC 3.5.2.6)protein26344% helix, 18% strandG3G192

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 4 copies · chains A
  • CL · Chloride ion · ion · 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
1610.300.7520empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7R3Q · Crystal structure of CTX-M-15 G238C/A240 insert mutant apoenzyme · the same entry in another collection · chain A against A, TM-score 1.00

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