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Structure of phanerochaete chrysosporium cellobiohydrolase CEL7D (CBH58) in complex with cellobiose

Analyse Structure of phanerochaete chrysosporium cellobiohydrolase CEL7D (CBH58) in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1Z3T
Type
protein
Length
431 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cellulase
EC
3.2.1.91
UniProt
Q7LIJ0
Ligands
BGC, NAG
Pockets
2 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 14% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACellulase (EC 3.2.1.91)protein43114% helix, 35% strandQ7LIJ0

Ligands and binding sites

  • BGC · beta-D-glucopyranose · sugar · 2 copies · chains A
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18770.760.8067BGC
2500.390.8218empty

Modifications

Observed in the structure: 8 disulfide, 1 glycan, 1 modified (disulfide, N-glycosylation, cyclization).

Compared structures

  • 1Z3T · Structure of Phanerochaete chrysosporium cellobiohydrolase Cel7D (CBH58) in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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