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Crystal structure of lacb from trametes sp. AH28-2

Analyse Crystal structure of lacb from trametes sp. AH28-2 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3KW7
Type
protein
Length
1,004 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Laccase B
EC
1.10.3.2
UniProt
Q5I7J0
Ligands
NAG, CU
Pockets
10 · best druggability 0.53

Structure

x-ray diffraction · 1 distinct chain · 10% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BLaccase B (EC 1.10.3.2)protein50210% helix, 37% strandQ5I7J0

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 12 copies · chains A, B
  • CU · Copper (II) ion · metal · 8 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12240.530.7734empty
22010.520.7737empty
3860.520.8420empty
4980.490.8121empty
5950.420.7819empty

Interfaces

1 interface between chains.

  • A–B · 146 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 glycan, 4 disulfide (N-glycosylation, disulfide).

Compared structures

  • 3KW7 · Crystal structure of LacB from Trametes sp. AH28-2 · the same entry in another collection · chain A against A, TM-score 1.00

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