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Structural insights into the reduction mechanism of saccharomyces cerevisia riboflavin biosynthesis reductase RIB7

Analyse Structural insights into the reduction mechanism of saccharomyces cerevisia… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4HA7
Type
protein
Length
426 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
2,5-diamino-6-ribosylamino-4(3H)-pyrimidinone 5'-phosphate reductase
EC
1.1.1.302
UniProt
P33312
Pockets
7 · best druggability 0.58

Structure

x-ray diffraction · 2 distinct chains · 22% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A2,5-diamino-6-ribosylamino-4(3H)-pyrimidinone 5'-phosphate reductase (EC 1.1.1.302)protein22122% helix, 28% strandP33312
B2,5-diamino-6-ribosylamino-4(3H)-pyrimidinone 5'-phosphate reductase (EC 1.1.1.302)protein20522% helix, 28% strandP33312

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13660.580.7639empty
21180.400.7519empty
3730.390.7818empty
4980.380.7621empty
5750.290.7320empty

Interfaces

1 interface between chains.

  • A–B · 1338 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • 4HA7 · Structural insights into the reduction mechanism of Saccharomyces cerevisia Riboflavin… · the same entry in another collection · chain A against A, TM-score 1.00
  • P33312 · AlphaFold monomer V2.0 prediction for 2,5-diamino-6-ribosylamino-4(3H)-pyrimidinone… · a predicted model of the same protein · chain B against A, TM-score 0.98

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