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MolNFT v1 · #10797 · protein

Crystal structure of urate oxidase from bacillus sp. tb-90 co- crystallized with 8-azaxanthine

1J2G · Uricase: “Crystal structure of urate oxidase from bacillus sp. tb-90 co- crystallized with 8-azaxanthine”. X-ray diffraction, 2 ligands (AZA, SO4), 13 pockets (best druggability 0.77). MolNFT v1 #10797 on GenesisL1: 3D structure…

PDB
1J2G
Type
protein
Length
1,224 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uricase
EC
1.7.3.3
UniProt
Q45697
Ligands
AZA, SO4
Pockets
13 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 24% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DUricase (EC 1.7.3.3)protein30624% helix, 40% strandQ45697

Ligands and binding sites

  • AZA · 8-azaxanthine · ligand · 4 copies · chains A, B, C, D
  • SO4 · Sulfate ion · ion · 4 copies · chains A, C, B, D

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

Pockets

13 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18410.770.8084empty
28110.760.7975empty
33250.710.8444AZA
43280.690.8343AZA
53100.690.8343AZA

Interfaces

6 interfaces between chains.

  • A–D · 2911 Ų buried · 54 hydrogen bonds · protein-protein
  • A–B · 2842 Ų buried · 48 hydrogen bonds · protein-protein
  • C–D · 2836 Ų buried · 45 hydrogen bonds · protein-protein
  • B–C · 2830 Ų buried · 54 hydrogen bonds · protein-protein
  • A–C · 268 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 1J2G · Crystal structure of Urate oxidase from Bacillus SP. TB-90 co-crystallized with… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q45697 · AlphaFold monomer V2.0 prediction for uric acid degradation bifunctional protein (Q45697) · a predicted model of the same protein · chain A against A, TM-score 1.00

Analyse

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