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Ensemble refinement of the protein crystal structure of putative tropinone reductase from arabidopsis thaliana gene AT1G07440

Analyse Ensemble refinement of the protein crystal structure of putative tropinone… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2Q45
Type
protein
Length
218 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative tropinone reductase homolog AT1G07440
EC
1.1.1.-
UniProt
Q9ASX2
Pockets
2 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative tropinone reductase homolog AT1G07440 (EC 1.1.1.-)protein21850% helix, 17% strandQ9ASX2

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11830.620.8328empty
21360.460.7725empty

Compared structures

  • 2Q45 · Ensemble refinement of the protein crystal structure of putative tropi reductase from… · the same entry in another collection · chain A against A, TM-score 1.00

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