Research workbench
Chaperone spy bound to IM7 6-45 ensemble
Analyse Chaperone spy bound to IM7 6-45 ensemble in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 5WNW
- Type
- protein
- Length
- 224 residues
- Chains
- 3
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Periplasmic chaperone spy; Colicin-E7 immunity protein
- UniProt
- P77754, Q03708
- Ligands
- ZN, CL
- Pockets
- 2 · best druggability 0.61
Structure
x-ray diffraction · 3 distinct chains · 58% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Periplasmic chaperone spy | protein | 95 | 71% helix, 0% strand | P77754 |
| B | Periplasmic chaperone spy | protein | 92 | 70% helix, 0% strand | P77754 |
| C | Colicin-E7 immunity protein | protein | 37 | 0% helix, 0% strand | Q03708 |
Ligands and binding sites
- ZN · Zinc ion · metal · 8 copies · chains A, B
- CL · Chloride ion · ion · 2 copies · chains A, B
- IMD · Imidazole · additive · 3 copies · chains A, B
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.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 492 | 0.61 | 0.75 | 47 | empty |
| 2 | 66 | 0.40 | 0.80 | 17 | ZN |
Interfaces
3 interfaces between chains.
- A–B · 1673 Ų buried · 25 hydrogen bonds · protein-protein
- B–C · 110 Ų buried · 0 hydrogen bonds · protein-protein
- A–C · 82 Ų buried · 0 hydrogen bonds · protein-protein
Compared structures
- 5WNW · Chaperone Spy bound to Im7 6-45 ensemble · the same entry in another collection · chain A against A, TM-score 1.00
- P77754 · AlphaFold monomer V2.0 prediction for periplasmic chaperone spy (P77754) · a predicted model of the same protein · chain B against A, TM-score 0.78
- Q03708 · AlphaFold monomer V2.0 prediction for colicin-E7 immunity protein (Q03708) · a predicted model of the same protein · chain C against A, TM-score 0.20
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 P77754
- Every structure of UniProt Q03708
- Elsewhere: RCSB PDB 5WNW · PDBe 5WNW · UniProt P77754 · UniProt Q03708
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