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Crystal structure of phenylalanine hydroxylase A313T mutant with 7,8- dihydrobiopterin bound

Analyse Crystal structure of phenylalanine hydroxylase A313T mutant with 7,8… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1TG2
Type
protein
Length
308 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phenylalanine-4-hydroxylase
EC
1.14.16.1
UniProt
P00439
Ligands
H2B, FE
Pockets
3 · best druggability 0.68

Structure

x-ray diffraction · 1 distinct chain · 49% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhenylalanine-4-hydroxylase (EC 1.14.16.1)protein30849% helix, 12% strandP00439

Ligands and binding sites

  • H2B · 2-amino-6-(1,2-dihydroxy-propyl)-7,8-dihydro-6H-pteridin-4-one · ligand · chains A
  • FE · Fe (III) ion · metal · 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
14550.680.7945H2B
21120.440.7721empty
3700.370.7716empty

Compared structures

  • 1TG2 · Crystal structure of phenylalanine hydroxylase A313T mutant with 7,8-dihydrobiopterin… · the same entry in another collection · chain A against A, TM-score 1.00
  • P00439 · AlphaFold monomer V2.0 prediction for phenylalanine-4-hydroxylase (P00439) · a predicted model of the same protein · chain A against A, TM-score 0.99

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