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MolNFT v1 · #116316 · protein

Crystal structure of oxidized dehydroascorbate reductase (osdhar) from oryza sativa L. japonica

5D9V: “Crystal structure of oxidized dehydroascorbate reductase (osdhar) from oryza sativa L. japonica”. X-ray diffraction, 1 ligand (CA), 2 pockets (best druggability 0.44). MolNFT v1 #116316 on GenesisL1: 3D structure, binding sites and…

PDB
5D9V
Type
protein
Length
211 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dehydroascorbate reductase
UniProt
Q65XA0
Ligands
CA
Pockets
2 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADehydroascorbate reductaseprotein21151% helix, 11% strandQ65XA0

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · chains A
  • PEG · Di(hydroxyethyl)ether · additive · chains A

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11100.440.7823empty
2930.380.7620empty

Modifications

Observed in the structure: 1 modified (oxidation).

Compared structures

  • 5D9V · Crystal structure of oxidized dehydroascorbate reductase (OsDHAR) from Oryza sativa L.… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q65XA0 · AlphaFold monomer V2.0 prediction for probable glutathione S-transferase DHAR1, cytosolic… · a predicted model of the same protein · chain A against A, TM-score 0.99

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