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The P56A mutant of lactococcus lactis dihydroorotate dehydrogenase a

Analyse The P56A mutant of lactococcus lactis dihydroorotate dehydrogenase a in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1JRB
Type
protein
Length
622 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dihydroorotate dehydrogenase a
EC
1.3.3.1
UniProt
P54321
Ligands
FMN, ORO
Pockets
4 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 37% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BDihydroorotate dehydrogenase a (EC 1.3.3.1)protein31137% helix, 20% strandP54321

Ligands and binding sites

  • FMN · Flavin mononucleotide · ligand · 2 copies · chains A, B
  • ORO · Orotic acid · ligand · 2 copies · chains A, B

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

Pockets

4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15680.770.8490FMN, ORO
24890.770.8581FMN, ORO
31220.550.8219empty
4520.360.8015empty

Interfaces

1 interface between chains.

  • A–B · 2309 Ų buried · 26 hydrogen bonds · protein-protein

Compared structures

  • 1JRB · The P56A mutant of Lactococcus lactis dihydroorotate dehydrogenase A · the same entry in another collection · chain A against A, TM-score 1.00

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