7P42
Crystal structure of IpgC in complex with a follow-up compound based on J2
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | Chaperone protein IpgC | polymer | 143 | 16310.5 | 2 | UniProt (P0A2U4) Pfam (PF07720) | Shigella flexneri | |
| 2 | C, G (A, B) | MAGNESIUM ION | non-polymer | 24.3 | 2 | Chemie (MG) PubChem (888) | |||
| 3 | D, H, I (A, B) | CHLORIDE ION | non-polymer | 35.5 | 3 | Chemie (CL) PubChem (312) | |||
| 4 | E (A) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 1 | Chemie (DMS) PubChem (679) | |||
| 5 | F, K (A, B) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 2 | Chemie (PEG) PubChem (8117) | |||
| 6 | J (B) | 2-(4,6-dimethylpyrimidin-2-yl)-3H-isoindol-1-imine | non-polymer | 238.3 | 1 | Chemie (5I8) PubChem (3466575) | |||
| 7 | L, M (A, B) | water | water | 18.0 | 213 | Chemie (HOH) |
Sequence modifications
A, B: 10 - 151 (UniProt: P0A2U4)
| PDB | External Database | Details |
|---|---|---|
| Gly 9 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 32621.0 | |
| Non-Polymers* | Number of molecules | 9 |
| Total formula weight | 683.6 | |
| All* | Total formula weight | 33304.6 |
