6HSF
Crystal structure of Schistosoma mansoni HDAC8 mutant H292M complexed with PCI-34051
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C, D (A, B, C, D) | Histone deacetylase | polymer | 447 | 50576.1 | 4 | UniProt (A5H660) Pfam (PF00850) | Schistosoma mansoni (Blood fluke) | |
| 2 | E, JA, Q, Y (A, D, B, C) | ZINC ION | non-polymer | 65.4 | 4 | Chemie (ZN) | |||
| 3 | AA, F, G, KA, LA... (C, A, D, B) | POTASSIUM ION | non-polymer | 39.1 | 8 | Chemie (K) | |||
| 4 | BA, H, MA, T (C, A, D, B) | 1-[(4-methoxyphenyl)methyl]-~{N}-oxidanyl-indole-6-carboxamide | non-polymer | 296.3 | 4 | Chemie (GKW) | |||
| 5 | CA, DA, EA, FA, I... (C, A, D, B) | DIMETHYLFORMAMIDE | non-polymer | 73.1 | 16 | Chemie (DMF) | |||
| 6 | GA, HA, IA, O, P... (C, A, D) | GLYCEROL | non-polymer | 92.1 | 7 | Chemie (GOL) | |||
| 7 | RA, SA, TA, UA (A, B, C, D) | water | water | 18.0 | 797 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 1 - 440 (UniProt: A5H660)
| PDB | External Database | Details |
|---|---|---|
| His 0 | - | expression tag |
| Met 292 | His 292 | engineered mutation |
| Gly 441 | - | expression tag |
| Ser 442 | - | expression tag |
| Leu 443 | - | expression tag |
| Val 444 | - | expression tag |
| Pro 445 | - | expression tag |
| Arg 446 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 202304.3 | |
| Non-Polymers* | Number of molecules | 39 |
| Total formula weight | 3573.9 | |
| All* | Total formula weight | 205878.2 |
