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MolNFT v1 · #170738 · protein

X-ray structure of flavobacterium johnsoniae chitobiase (FJGH20)

6YHH · Beta-N-acetylglucosaminidase-like protein glycoside…: “X-ray structure of flavobacterium johnsoniae chitobiase (FJGH20)”. X-ray diffraction, 14 pockets (best druggability 0.87). MolNFT v1 #170738 on GenesisL1: 3D structure, binding…

PDB
6YHH
Type
protein
Length
1,310 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-N-acetylglucosaminidase-like protein glycoside hydrolase family 20
EC
3.2.1.52
UniProt
A5FB64
Pockets
14 · best druggability 0.87

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BBeta-N-acetylglucosaminidase-like protein glycoside hydrolase family 20 (EC 3.2.1.52)protein65544% helix, 16% strandA5FB64

Ligands and binding sites

  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · 2 copies · chains A, B
  • GOL · Glycerol · additive · chains B

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

Pockets

14 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18810.870.8997empty
211700.800.8187empty
32350.680.8538TRS
42400.680.8439TRS
5560.670.9521empty

Interfaces

1 interface between chains.

  • A–B · 2192 Ų buried · 28 hydrogen bonds · protein-protein

Compared structures

  • 6YHH · X-ray Structure of Flavobacterium johnsoniae chitobiase (FjGH20) · the same entry in another collection · chain A against A, TM-score 1.00

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