5CW8
Crystal structure of Mycobacterium tuberculosis KstR in complex with 3-oxo-4-cholesten-26-oyl-CoA
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) | HTH-type transcriptional repressor KstR | polymer | 203 | 22352.5 | 2 | UniProt (P96856) Pfam (PF00440) Pfam (PF17925) | Mycobacterium tuberculosis | |
| 2 | C, D (A, B) | S-{1-[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,7-dihydroxy-6,6-dimethyl-3-oxido-8,12 -dioxo-2,4-dioxa-9,13-diaza-3lambda~5~-phosphapentadecan-15-yl} (2S,6R)-6-[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta [a]phenanthren-17-yl]-2-methylheptanethioate (non-preferred name) | non-polymer | 1084.2 | 2 | Chemie (55X) | |||
| 3 | E (B) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 1 | Chemie (PGE) | |||
| 4 | F, G (A, B) | water | water | 18.0 | 66 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 199 (UniProt: P96856)
| PDB | External Database | Details |
|---|---|---|
| Gly -3 | - | expression tag |
| Ala -2 | - | expression tag |
| Met -1 | - | expression tag |
| Glu 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 44705.0 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 2318.5 | |
| All* | Total formula weight | 47023.5 |
