7M7V
Crystal Structure of Mtb Pks13 Thioesterase domain in complex with Compound 6
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) | Polyketide synthase Pks13 | polymer | 286 | 31777.7 | 2 | UniProt (I6X8D2) Pfam (PF00975) | Mycobacterium tuberculosis | Termination polyketide synthase |
| 2 | C, D (A, B) | 5-hydroxy-2-(4-hydroxyphenyl)-N-methyl-4-[(2-oxa-6-azaspiro[3.4]octan-6-yl)methyl]-1-benzofuran-3-carboxamide | non-polymer | 408.4 | 2 | Chemie (Z3J) | |||
| 3 | E, F (A, B) | water | water | 18.0 | 96 | Chemie (HOH) |
Sequence modifications
A, B: 1451 - 1733 (UniProt: I6X8D2)
| PDB | External Database | Details |
|---|---|---|
| Ser 1448 | - | expression tag |
| Asn 1449 | - | expression tag |
| Ala 1450 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 63555.5 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 816.9 | |
| All* | Total formula weight | 64372.4 |
