Research workbench
The structure of the 2:1 (partially occupied) complex between stearoyl acyl carrier protein desaturase from ricinus communis (castor bean) and acyl carrier protein.
Analyse The structure of the 2:1 (partially occupied) complex between stearoyl acyl… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 2XZ0
- Type
- protein
- Length
- 1,120 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Acyl-[acyl-carrier-protein] desaturase, chloroplastic; Acyl carrier protein 1…
- EC
- 1.14.19.2
- UniProt
- P22337, P07854
- Ligands
- FE, ZN
- Pockets
- 14 · best druggability 0.78
Structure
x-ray diffraction · 2 distinct chains · 62% helix, 1% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, C | Acyl-[acyl-carrier-protein] desaturase, chloroplastic (EC 1.14.19.2) | protein | 346 | 67% helix, 2% strand | P22337 |
| D | Acyl carrier protein 1, chloroplastic | protein | 82 | 41% helix, 0% strand | P07854 |
Ligands and binding sites
- FE · Fe (III) ion · metal · 6 copies · chains A, B, C
- ZN · Zinc ion · metal · 3 copies · chains A, B, C
- EDO · 1,2-ethanediol · additive · chains B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
14 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 810 | 0.78 | 0.81 | 79 | FE |
| 2 | 750 | 0.77 | 0.81 | 80 | empty |
| 3 | 511 | 0.74 | 0.82 | 62 | empty |
| 4 | 638 | 0.69 | 0.78 | 51 | empty |
| 5 | 57 | 0.65 | 0.94 | 18 | empty |
Interfaces
4 interfaces between chains.
- A–B · 2811 Ų buried · 41 hydrogen bonds · protein-protein
- C–D · 667 Ų buried · 8 hydrogen bonds · protein-protein
- B–D · 570 Ų buried · 14 hydrogen bonds · protein-protein
- B–C · 407 Ų buried · 4 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 1 modified (phosphorylation).
Compared structures
- 2XZ0 · The Structure of the 2:1 (Partially Occupied) Complex Between Stearoyl Acyl Carrier… · 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
- P07854 · AlphaFold monomer V2.0 prediction for acyl carrier protein 1, chloroplastic (P07854) · a predicted model of the same protein · chain D against A, TM-score 0.87
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt P22337
- Every structure of UniProt P07854
- Elsewhere: RCSB PDB 2XZ0 · PDBe 2XZ0 · UniProt P22337 · UniProt P07854
GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.