MolNFT v1 · #179847 · protein
The acyl chains of phosphoinositide PIP3 alter the structure and function of nuclear receptor steroidogenic factor-1 (sf-1)
7KHT · Steroidogenic factor 1: “The acyl chains of phosphoinositide PIP3 alter the structure and function of nuclear receptor steroidogenic…”. X-ray diffraction, 1 ligand (WES), 3 pockets (best druggability 0.83). MolNFT v1 #179847 on…
- PDB
- 7KHT
- Type
- protein
- Length
- 247 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Steroidogenic factor 1; Peroxisome proliferator-activated receptor gamma coactivator…
- UniProt
- Q13285, Q9UBK2
- Ligands
- WES
- Pockets
- 3 · best druggability 0.83
Structure
x-ray diffraction · 2 distinct chains · 71% helix, 2% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Steroidogenic factor 1 | protein | 235 | 73% helix, 3% strand | Q13285 |
| B | Peroxisome proliferator-activated receptor gamma coactivator 1-alpha peptide | protein | 12 | 42% helix, 0% strand | Q9UBK2 |
Ligands and binding sites
- WES · (2S)-3-{[(S)-{[(1S,2S,3R,4S,5S,6S)-2,6-dihydroxy-3,4,5-tris(phosphonooxy)cyclohexyl]oxy}(hydroxy) phosphoryl]oxy}propane-1,2-diyl (9e,9'e)di-octadec-9-enoate · ligand · 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, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 511 | 0.83 | 0.88 | 37 | WES |
| 2 | 147 | 0.69 | 0.89 | 25 | empty |
| 3 | 79 | 0.31 | 0.73 | 20 | empty |
Interfaces
1 interface between chains.
- A–B · 469 Ų buried · 4 hydrogen bonds · protein-protein
Compared structures
- 7KHT · The acyl chains of phosphoinositide PIP3 alter the structure and function of nuclear… · the same entry in another collection · chain A against A, TM-score 1.00
- Q13285 · AlphaFold monomer V2.0 prediction for steroidogenic factor 1 (Q13285) · a predicted model of the same protein · chain A against A, TM-score 0.96
- Q9UBK2 · AlphaFold monomer V2.0 prediction for peroxisome proliferator- activated receptor gamma… · a predicted model of the same protein · chain B against A, TM-score 0.53
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 Q13285
- Every structure of UniProt Q9UBK2
- Elsewhere: RCSB PDB 7KHT · PDBe 7KHT · UniProt Q13285 · UniProt Q9UBK2
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