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MolNFT v1 · #119170 · protein

F206W mutant of FAD synthetase from corynebacterium ammoniagenes

5FNZ · Riboflavin biosynthesis protein ribf: “F206W mutant of FAD synthetase from corynebacterium ammoniagenes”. X-ray diffraction, 2 ligands (PPV, SO4), 9 pockets (best druggability 0.79). MolNFT v1 #119170 on GenesisL1: 3D structure…

PDB
5FNZ
Type
protein
Length
661 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Riboflavin biosynthesis protein ribf
EC
2.7.1.26, 2.7.7.2
UniProt
Q59263
Ligands
PPV, SO4
Pockets
9 · best druggability 0.79

Structure

x-ray diffraction · 2 distinct chains · 30% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARiboflavin biosynthesis protein ribf (EC 2.7.1.26, 2.7.7.2)protein32830% helix, 29% strandQ59263
BRiboflavin biosynthesis protein ribf (EC 2.7.1.26, 2.7.7.2)protein33329% helix, 29% strandQ59263

Ligands and binding sites

  • PPV · Pyrophosphate · ligand · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18830.790.81106SO4
23500.640.7942PPV
33370.630.7940PPV
42190.580.8040empty
52240.500.7633empty

Interfaces

1 interface between chains.

  • A–B · 833 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 5FNZ · F206W mutant of FAD synthetase from Corynebacterium ammoniagenes · the same entry in another collection · chain A against A, TM-score 1.00
  • Q59263 · AlphaFold monomer V2.0 prediction for bifunctional riboflavin KINASE/FMN… · a predicted model of the same protein · chain A against A, TM-score 1.00

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