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MolNFT v1 · #119172 · protein

E301A mutant of FAD synthetase from corynebacterium ammoniagenes

5FO1 · Riboflavin biosynthesis protein ribf: “E301A mutant of FAD synthetase from corynebacterium ammoniagenes”. X-ray diffraction, 2 ligands (PPV, SO4), 11 pockets (best druggability 0.77). MolNFT v1 #119172 on GenesisL1: 3D structure…

PDB
5FO1
Type
protein
Length
673 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
11 · best druggability 0.77

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
ARiboflavin biosynthesis protein ribf (EC 2.7.1.26, 2.7.7.2)protein33829% helix, 28% strandQ59263
BRiboflavin biosynthesis protein ribf (EC 2.7.1.26, 2.7.7.2)protein33530% helix, 30% 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

11 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17590.770.8188SO4
23580.650.7941PPV
33290.620.7939PPV
42210.570.7942empty
5940.530.8428empty

Interfaces

1 interface between chains.

  • A–B · 869 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 5FO1 · E301A 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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