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MolNFT v1 · #184649 · protein

Crystal structure of human spermine oxidase

7OXL · Spermine OXIDASE,SPERMINE OXIDASE,SPERMINE oxidase: “Crystal structure of human spermine oxidase”. X-ray diffraction, 2 ligands (6YU, CL), 3 pockets (best druggability 0.80). MolNFT v1 #184649 on GenesisL1: 3D structure, binding…

PDB
7OXL
Type
protein
Length
442 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Spermine OXIDASE,SPERMINE OXIDASE,SPERMINE oxidase
EC
1.5.3.16
UniProt
Q9NWM0
Ligands
6YU, CL
Pockets
3 · best druggability 0.80

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASpermine OXIDASE,SPERMINE OXIDASE,SPERMINE oxidase (EC 1.5.3.16)protein44243% helix, 20% strandQ9NWM0

Ligands and binding sites

  • 6YU · FAD-MDL72527 adduct · ligand · chains A
  • CL · Chloride ion · ion · 2 copies · chains A
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15540.800.86696YU
24500.610.7640CL
32250.550.7835MPD

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 7OXL · Crystal structure of human Spermine Oxidase · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9NWM0 · AlphaFold monomer V2.0 prediction for spermine oxidase (Q9NWM0) · a predicted model of the same protein · chain A against A, TM-score 0.96

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