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MolNFT v1 · #163821 · protein

Cold-adapted beta-D-galactosidase from arthrobacter sp. 32CB mutant E441Q

6SE8 · Beta-galactosidase: “Cold-adapted beta-D-galactosidase from arthrobacter sp. 32CB mutant E441Q”. X-ray diffraction, 1 ligand (NA), 16 pockets (best druggability 0.63). MolNFT v1 #163821 on GenesisL1: 3D structure, binding sites and…

PDB
6SE8
Type
protein
Length
1,001 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-galactosidase
EC
3.2.1.23
UniProt
A0A023UGN9
Ligands
NA
Pockets
16 · best druggability 0.63

Structure

x-ray diffraction · 1 distinct chain · 16% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABeta-galactosidase (EC 3.2.1.23)protein100116% helix, 38% strandA0A023UGN9

Ligands and binding sites

  • NA · Sodium ion · metal · 6 copies · chains A
  • ACT · Acetate ion · additive · 16 copies · chains A
  • MLI · Malonate ion · additive · 7 copies · chains A
  • FMT · Formic acid · additive · 2 copies · chains A
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11960.630.8327empty
22150.610.8134empty
3920.550.8519empty
42760.510.7442NA
51960.500.7630empty

Compared structures

  • 6SE8 · Cold-adapted beta-D-galactosidase from Arthrobacter sp. 32cB mutant E441Q · the same entry in another collection · chain A against A, TM-score 1.00

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