MolNFT v1 · #190370 · protein
Gpr domain of drosophila P5CS filament with glutamate and atpgammas
7WXI · Delta-1-pyrroline-5-carboxylate synthase: “Gpr domain of drosophila P5CS filament with glutamate and atpgammas”. Electron microscopy, 1 ligand (RGP), 11 pockets (best druggability 0.80). MolNFT v1 #190370 on GenesisL1: 3D structure…
- PDB
- 7WXI
- Type
- protein
- Length
- 860 residues
- Chains
- 2
- Method
- electron microscopy
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Delta-1-pyrroline-5-carboxylate synthase
- EC
- 2.7.2.11, 1.2.1.41
- UniProt
- Q9VNW6
- Ligands
- RGP
- Pockets
- 11 · best druggability 0.80
Structure
electron microscopy · 1 distinct chain · 42% helix, 12% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Delta-1-pyrroline-5-carboxylate synthase (EC 2.7.2.11, 1.2.1.41) | protein | 430 | 42% helix, 12% strand | Q9VNW6 |
Ligands and binding sites
- RGP · Gamma-glutamyl phosphate · ligand · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
11 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1015 | 0.80 | 0.81 | 76 | empty |
| 2 | 749 | 0.77 | 0.82 | 41 | empty |
| 3 | 732 | 0.72 | 0.79 | 57 | RGP |
| 4 | 678 | 0.71 | 0.78 | 57 | RGP |
| 5 | 263 | 0.58 | 0.79 | 50 | empty |
Interfaces
1 interface between chains.
- A–B · 2946 Ų buried · 32 hydrogen bonds · protein-protein
Compared structures
- 7WXI · GPR domain of Drosophila P5CS filament with glutamate and ATPgammaS · the same entry in another collection · chain A against A, TM-score 1.00
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 Q9VNW6
- Elsewhere: RCSB PDB 7WXI · PDBe 7WXI · UniProt Q9VNW6
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