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MolNFT v1 · #153879 · protein

Crystal structure of D464A L465A mutant of fgam synthetase

6JTA · Phosphoribosylformylglycinamidine synthase: “Crystal structure of D464A L465A mutant of fgam synthetase”. X-ray diffraction, 4 ligands (ADP, GLN, MG), 10 pockets (best druggability 0.86). MolNFT v1 #153879 on GenesisL1: 3D…

PDB
6JTA
Type
protein
Length
1,298 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoribosylformylglycinamidine synthase
EC
6.3.5.3
UniProt
A0A0D6F9Y3
Ligands
ADP, GLN, MG, SO4
Pockets
10 · best druggability 0.86

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoribosylformylglycinamidine synthase (EC 6.3.5.3)protein129835% helix, 27% strandA0A0D6F9Y3

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • GLN · Glutamine · ligand · chains A
  • MG · Magnesium ion · metal · 3 copies · chains A
  • SO4 · Sulfate ion · ion · 18 copies · chains A
  • EDO · 1,2-ethanediol · additive · 23 copies · chains A
  • GOL · Glycerol · additive · 12 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12920.860.9745ADP, MG
29980.830.8496EDO, SO4
37120.800.8493GOL, EDO, SO4
42840.790.9134GOL
51220.790.9832empty

Compared structures

  • 6JTA · Crystal Structure of D464A L465A mutant of FGAM Synthetase · the same entry in another collection · chain A against A, TM-score 1.00

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