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Truncated form of carbohydrate esterase from gut microbiota

Analyse Truncated form of carbohydrate esterase from gut microbiota in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6XYC
Type
protein
Length
285 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Acetyl xylan esterase
Ligands
AES
Pockets
1 · best druggability 0.35

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAcetyl xylan esteraseprotein28534% helix, 23% strand—

Ligands and binding sites

  • AES · 4-(2-aminoethyl)benzenesulfonyl fluoride · ligand · 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
1500.350.7914AES

Modifications

Observed in the structure: 1 covalent, 1 disulfide (covalent ligand, disulfide).

Compared structures

  • 6XYC · Truncated form of carbohydrate esterase from gut microbiota · the same entry in another collection · chain A against A, TM-score 1.00

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