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MolNFT v1 · #24611 · protein

Ascobate peroxidase from soybean cytosol in complex with salicylhydroxamic acid

1V0H · Ascorbate peroxidase: “Ascobate peroxidase from soybean cytosol in complex with salicylhydroxamic acid”. X-ray diffraction, 3 ligands (HEM, SHA, NA), 1 pocket (best druggability 0.78). MolNFT v1 #24611 on GenesisL1: 3D structure…

PDB
1V0H
Type
protein
Length
249 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ascorbate peroxidase
EC
1.11.1.11
UniProt
Q43758
Ligands
HEM, SHA, NA
Pockets
1 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 54% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
XAscorbate peroxidase (EC 1.11.1.11)protein24954% helix, 2% strandQ43758

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · chains X
  • SHA · Salicylhydroxamic acid · ligand · chains X
  • NA · Sodium ion · metal · chains X

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13710.780.8745HEM, SHA

Compared structures

  • 1V0H · Ascobate peroxidase from soybean cytosol in complex with salicylhydroxamic acid · the same entry in another collection · chain X against X, TM-score 1.00

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