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MolNFT v1 · #97638 · protein

Crystal structure of candida glabrata FMN adenylyltransferase D181A mutant

4KKV · Similar to UNIPROT|P38913 saccharomyces cerevisiae YDL045C…: “Crystal structure of candida glabrata FMN adenylyltransferase D181A mutant”. X-ray diffraction, 2 ligands (BGC, CL), 3 pockets (best druggability 0.70). MolNFT v1 #97638…

PDB
4KKV
Type
protein
Length
295 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Similar to UNIPROT|P38913 saccharomyces cerevisiae YDL045C FAD synthetase
EC
2.7.7.2
UniProt
Q6FNA9
Ligands
BGC, CL
Pockets
3 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASimilar to UNIPROT|P38913 saccharomyces cerevisiae YDL045C FAD synthetase (EC 2.7.7.2)protein29539% helix, 9% strandQ6FNA9

Ligands and binding sites

  • BGC · beta-D-glucopyranose · sugar · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15280.700.8046CL
2790.460.8123empty
3920.450.8015empty

Compared structures

  • 4KKV · Crystal structure of candida glabrata FMN adenylyltransferase D181A Mutant · the same entry in another collection · chain A against A, TM-score 1.00

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