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Smchia sliding-intermediate with chitotriose

Analyse Smchia sliding-intermediate with chitotriose in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5Z7P
Type
protein
Length
540 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chitinase a
Ligands
NAG
Pockets
3 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 28% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChitinase aprotein54028% helix, 27% strand—

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 3 copies · chains A
  • GOL · Glycerol · additive · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16450.710.7865NAG
21020.390.7630GOL
31070.370.7522GOL

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5Z7P · SmChiA sliding-intermediate with chitotriose · the same entry in another collection · chain A against A, TM-score 1.00

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