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Crystal structure of isoflavone reductase

Analyse Crystal structure of isoflavone reductase in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2GAS
Type
protein
Length
614 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Isoflavone reductase
UniProt
P52575
Pockets
5 · best druggability 0.81

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BIsoflavone reductaseprotein30743% helix, 17% strandP52575

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17940.810.8479empty
28460.800.8375empty
31160.420.7617empty
41010.410.7715empty
5580.330.7713empty

Interfaces

1 interface between chains.

  • A–B · 1684 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • 2GAS · Crystal Structure of Isoflavone Reductase · the same entry in another collection · chain A against A, TM-score 1.00
  • P52575 · AlphaFold monomer V2.0 prediction for isoflavone reductase (P52575) · a predicted model of the same protein · chain A against A, TM-score 0.98

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