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MolNFT v1 · #37344 · protein

Structure of a putative phosphoserine aminotransferase from mycobacterium tuberculosis

2FYF: “Structure of a putative phosphoserine aminotransferase from mycobacterium tuberculosis”. X-ray diffraction, 3 ligands (PLP, PC4, SO4), 3 pockets (best druggability 0.77). MolNFT v1 #37344 on GenesisL1: 3D structure, binding sites…

PDB
2FYF
Type
protein
Length
736 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoserine aminotransferase
EC
2.6.1.52
UniProt
P63514
Ligands
PLP, PC4, SO4
Pockets
3 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPhosphoserine aminotransferase (EC 2.6.1.52)protein36839% helix, 15% strandP63514

Ligands and binding sites

  • PLP · Pyridoxal-5'-phosphate · ligand · 2 copies · chains A, B
  • PC4 · Tetrachloroplatinate(ii) · metal · 6 copies · chains A, B
  • SO4 · Sulfate ion · ion · 2 copies · chains A, B
  • GOL · Glycerol · additive · 7 copies · chains A, B

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

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12610.770.9049PLP, SO4
22410.760.9039SO4, PLP
3850.340.7419empty

Interfaces

1 interface between chains.

  • A–B · 2190 Ų buried · 19 hydrogen bonds · protein-protein

Compared structures

  • 2FYF · Structure of a putative phosphoserine aminotransferase from Mycobacterium Tuberculosis · the same entry in another collection · chain A against A, TM-score 1.00

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