MolNFT v1 · #184195 · protein
Cryo-EM structure of DRS2P-CDC50P in the [PS]E2-alfx state
7OH6 · Probable phospholipid-transporting ATPase DRS2,PROBABLE…: “Cryo-EM structure of DRS2P-CDC50P in the [PS]E2-alfx state”. Electron microscopy, 6 ligands (2Y5, ALF, Q3G), 17 pockets (best druggability 0.82). MolNFT v1 #184195 on…
- PDB
- 7OH6
- Type
- protein
- Length
- 1,414 residues
- Chains
- 2
- Method
- electron microscopy
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Probable phospholipid-transporting ATPase DRS2,PROBABLE phospholipid-transporting ATPase…
- EC
- 7.6.2.1
- UniProt
- P39524, P25656
- Ligands
- 2Y5, ALF, Q3G, NAG, BMA, MG
- Pockets
- 17 · best druggability 0.82
Structure
electron microscopy · 2 distinct chains · 40% helix, 18% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Probable phospholipid-transporting ATPase DRS2,PROBABLE phospholipid-transporting ATPase DRS2 (EC 7.6.2.1) | protein | 1064 | 45% helix, 17% strand | P39524 |
| C | Cell division control protein 50 | protein | 350 | 25% helix, 20% strand | P25656 |
Ligands and binding sites
- 2Y5 · (2R)-1-{[(R)-hydroxy{[(1r,2r,3r,4r,5s,6r)-2,3,5,6-tetrahydroxy-4-(phosphonooxy) cyclohexyl]oxy}phosphoryl]oxy}-3-(octadecanoyloxy) propan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate · ligand · chains A
- ALF · Tetrafluoroaluminate ion · ligand · chains A
- Q3G · O-[(R)-[(2S)-2-(hexadecanoyloxy)-3-(octadecanoyloxy) propoxy](hydroxy)phosphoryl]-D-serine · ligand · chains A
- NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 5 copies · chains C
- BMA · beta-D-mannopyranose · sugar
- MG · Magnesium ion · metal · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
17 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1058 | 0.82 | 0.83 | 81 | empty |
| 2 | 793 | 0.78 | 0.82 | 69 | empty |
| 3 | 857 | 0.77 | 0.80 | 58 | empty |
| 4 | 79 | 0.74 | 0.98 | 26 | empty |
| 5 | 688 | 0.73 | 0.79 | 85 | empty |
Interfaces
1 interface between chains.
- A–C · 4613 Ų buried · 45 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 3 glycan, 2 disulfide (N-glycosylation, disulfide).
Compared structures
- 7OH6 · Cryo-EM structure of Drs2p-Cdc50p in the [PS]E2-AlFx state · the same entry in another collection · chain C against C, TM-score 1.00
- P25656 · AlphaFold monomer V2.0 prediction for cell division control protein 50 (P25656) · a predicted model of the same protein · chain C against A, TM-score 0.97
- P39524 · AlphaFold monomer V2.0 prediction for probable phospholipid- transporting ATPase DRS2… · a predicted model of the same protein · chain A against A, TM-score 0.88
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 P39524
- Every structure of UniProt P25656
- Elsewhere: RCSB PDB 7OH6 · PDBe 7OH6 · UniProt P39524 · UniProt P25656
GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.