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MolNFT v1 · #179274 · protein

Human serine palmitoyltransferase complex SPTLC1/SPLTC2/SSSPTA protomer

7K0J · Serine palmitoyltransferase 1: “Human serine palmitoyltransferase complex SPTLC1/SPLTC2/SSSPTA protomer”. Electron microscopy, 2 ligands (POV, PLP), 10 pockets (best druggability 0.84). MolNFT v1 #179274 on GenesisL1: 3D structure…

PDB
7K0J
Type
protein
Length
977 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Serine palmitoyltransferase 1; Serine palmitoyltransferase 2; Serine palmitoyltransferase…
EC
2.3.1.50
UniProt
O15269, O15270, Q969W0
Ligands
POV, PLP
Pockets
10 · best druggability 0.84

Structure

electron microscopy · 3 distinct chains · 44% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASerine palmitoyltransferase 1 (EC 2.3.1.50)protein42342% helix, 15% strandO15269
BSerine palmitoyltransferase 2 (EC 2.3.1.50)protein49241% helix, 17% strandO15270
CSerine palmitoyltransferase small subunit aprotein6279% helix, 0% strandQ969W0

Ligands and binding sites

  • POV · (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate · ligand · 2 copies · chains B, C
  • PLP · Pyridoxal-5'-phosphate · ligand · chains A, B

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

Pockets

10 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110580.840.85109PLP
21490.800.9629empty
31460.600.8432empty
42450.560.7837empty
52190.550.7840empty

Interfaces

2 interfaces between chains.

  • A–B · 5012 Ų buried · 45 hydrogen bonds · protein-protein
  • B–C · 939 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 cofactor (pyridoxal phosphate Schiff base).

Compared structures

  • 7K0J · Human serine palmitoyltransferase complex SPTLC1/SPLTC2/ssSPTa protomer · the same entry in another collection · chain A against A, TM-score 1.00
  • O15270 · AlphaFold monomer V2.0 prediction for serine palmitoyltransferase 2 (O15270) · a predicted model of the same protein · chain B against A, TM-score 0.97
  • O15269 · AlphaFold monomer V2.0 prediction for serine palmitoyltransferase 1 (O15269) · a predicted model of the same protein · chain A against A, TM-score 0.97
  • Q969W0 · AlphaFold monomer V2.0 prediction for serine palmitoyltransferase small subunit a (Q969W0) · a predicted model of the same protein · chain C against A, TM-score 0.77

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