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MolNFT v1 · #124108 · protein

Crystal structure of laccasse from thermus thermophilus HB27 (ascorbic acid 10 min)

5K5K · Laccase: “Crystal structure of laccasse from thermus thermophilus HB27 (ascorbic acid 10 min)”. X-ray diffraction, 1 ligand (CU), 5 pockets (best druggability 0.62). MolNFT v1 #124108 on GenesisL1: 3D structure, binding sites and…

PDB
5K5K
Type
protein
Length
439 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Laccase
EC
1.10.3.2
UniProt
Q72HW2
Ligands
CU
Pockets
5 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 6% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALaccase (EC 1.10.3.2)protein4396% helix, 48% strandQ72HW2

Ligands and binding sites

  • CU · Copper (II) ion · metal · 3 copies · chains A
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · 12 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12700.620.8030MPD
21390.460.7724MPD
31000.410.7721empty
4940.380.7621empty
5560.270.7316empty

Compared structures

  • 5K5K · Crystal structure of laccasse from Thermus thermophilus HB27 (ascorbic acid 10 min) · the same entry in another collection · chain A against A, TM-score 1.00

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