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MolNFT v1 · #114247 · protein

Catalytic domain of coprinopsis cinerea GH62 alpha-L- arabinofuranosidase

5B6S · Glycosyl hydrolase family 62 protein: “Catalytic domain of coprinopsis cinerea GH62 alpha-L- arabinofuranosidase”. X-ray diffraction, 1 ligand (CA), 4 pockets (best druggability 0.61). MolNFT v1 #114247 on GenesisL1: 3D structure…

PDB
5B6S
Type
protein
Length
634 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycosyl hydrolase family 62 protein
EC
3.2.1.55
UniProt
A8NI40
Ligands
CA
Pockets
4 · best druggability 0.61

Structure

x-ray diffraction · 1 distinct chain · 9% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BGlycosyl hydrolase family 62 protein (EC 3.2.1.55)protein3179% helix, 44% strandA8NI40

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · chains A, B
  • GOL · Glycerol · additive · 7 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13610.610.7842GOL
2950.450.8022GOL
3940.420.7823GOL
41330.370.7329empty

Interfaces

1 interface between chains.

  • A–B · 283 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5B6S · Catalytic domain of Coprinopsis cinerea GH62 alpha-L-arabinofuranosidase · the same entry in another collection · chain A against A, TM-score 1.00

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