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Solution structure of C20S variant of dehydroascorbate reductase 3A from populus trichocarpa in complex with dehydroascorbic acid.

Analyse Solution structure of C20S variant of dehydroascorbate reductase 3A from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5MYE
Type
protein
Length
212 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dehydroascorbate reductase family protein
UniProt
B9HM36
Ligands
UU3
Pockets
2 · best druggability 0.46

Structure

solution nmr · 1 distinct chain · 48% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADehydroascorbate reductase family proteinprotein21248% helix, 10% strandB9HM36

Ligands and binding sites

  • UU3 · (5R)-5-[(1S)-1,2-bis(oxidanyl)ethyl]oxolane-2,3,4-trione · ligand · 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
1650.460.8215empty
21100.460.7821UU3

Compared structures

  • 5MYE · Solution structure of C20S variant of Dehydroascorbate reductase 3A from Populus… · the same entry in another collection · chain A against A, TM-score 1.00

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