6EXO
Crystal Structure of Rhodesain in complex with a Macrolactam Inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B | Cysteine protease | polymer | 215 | 22919.2 | 2 | UniProt (Q95PM0) Pfam (PF00112) In PDB | Trypanosoma brucei rhodesiense | |
| 2 | B, A | 1,2-ETHANEDIOL | non-polymer | 62.1 | 23 | Chemie (EDO) | |||
| 3 | A, B | (3~{S},14~{E})-19-chloranyl-~{N}-(1-cyanocyclopropyl)-5-oxidanylidene-12,17-dioxa-4-azatricyclo[16.2.2.0^{6,11}]docosa-1(21),6(11),7,9,14,18(22),19-heptaene-3-carboxamide | non-polymer | 451.9 | 2 | Chemie (C3E) | |||
| 4 | water | water | 18.0 | 219 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 215 (UniProt: Q95PM0)
| PDB | External Database | Details |
|---|---|---|
| Ala 172 | Ser 297 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 45838.4 | |
| Non-Polymers* | Number of molecules | 25 |
| Total formula weight | 2331.4 | |
| All* | Total formula weight | 48169.7 |
