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The crystal structure of the complex between stearoyl acyl carrier protein desaturase from ricinus communis (castor bean) and acetate.

Analyse The crystal structure of the complex between stearoyl acyl carrier protein… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1OQ9
Type
protein
Length
338 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Acyl-[acyl-carrier protein] desaturase
EC
1.14.19.2
UniProt
P22337
Ligands
FE
Pockets
2 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 63% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAcyl-[acyl-carrier protein] desaturase (EC 1.14.19.2)protein33863% helix, 2% strandP22337

Ligands and binding sites

  • FE · Fe (III) ion · metal · 2 copies · chains A
  • ACT · Acetate ion · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13580.740.8550ACT
2570.300.7514empty

Compared structures

  • 1OQ9 · The Crystal Structure of the Complex between Stearoyl Acyl Carrier Protein Desaturase… · the same entry in another collection · chain A against A, TM-score 1.00
  • P22337 · AlphaFold monomer V2.0 prediction for stearoyl-[acyl-carrier-protein] 9-desaturase… · a predicted model of the same protein · chain A against A, TM-score 0.99

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