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Structure native of the D405N mutant of the cellobiohydrolase CEL6A from humicola insolens at 1.5 ångström resolution

Analyse Structure native of the D405N mutant of the cellobiohydrolase CEL6A from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1OC6
Type
protein
Length
364 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cellobiohydrolase II
EC
3.2.1.91
Ligands
NAG, CA
Pockets
1 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACellobiohydrolase II (EC 3.2.1.91)protein36438% helix, 13% strand—

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains A
  • CA · Calcium ion · metal · chains A
  • GOL · Glycerol · additive · 7 copies · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15180.760.8455GOL

Modifications

Observed in the structure: 2 disulfide, 1 glycan (disulfide, N-glycosylation).

Compared structures

  • 1OC6 · structure native of the D405N mutant of the CELLOBIOHYDROLASE CEL6A FROM HUMICOLA… · the same entry in another collection · chain A against A, TM-score 1.00

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