9DI9
Rat branched chain ketoacid dehydrogenase kinase in complex with inhibitor
This is a non-PDB format compatible entry.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Branched-chain alpha-ketoacid dehydrogenase kinase | polymer | 388 | 44261.6 | 1 | UniProt (O14874) Pfam (PF10436) Pfam (PF02518) | Homo sapiens (human) | BCKDH kinase,BCKDHKIN,BDK,[3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase,mitochondrial |
| 2 | B (A) | ADENOSINE-5'-DIPHOSPHATE | non-polymer | 427.2 | 1 | Chemie (ADP) | |||
| 3 | C (A) | MAGNESIUM ION | non-polymer | 24.3 | 1 | Chemie (MG) | |||
| 4 | D (A) | POTASSIUM ION | non-polymer | 39.1 | 1 | Chemie (K) | |||
| 5 | E (A) | (3M)-6-fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-benzothiophene-2-carboxylic acid | non-polymer | 356.3 | 1 | Chemie (A1A40) | |||
| 6 | F (A) | PHOSPHATE ION | non-polymer | 95.0 | 1 | Chemie (PO4) | |||
| 7 | G (A) | water | water | 18.0 | 130 | Chemie (HOH) |
Sequence modifications
A: 1 - 382 (UniProt: O14874)
| PDB | External Database | Details |
|---|---|---|
| Leu 12 | Met 42 | conflict |
| Val 31 | Ala 61 | conflict |
| Val 32 | Ala 62 | conflict |
| Ser 48 | Ala 78 | conflict |
| Gly 61 | Ala 91 | conflict |
| Ser 81 | Cys 111 | conflict |
| Gly 328 | Ala 358 | conflict |
| His 383 | - | expression tag |
| His 384 | - | expression tag |
| His 385 | - | expression tag |
| His 386 | - | expression tag |
| His 387 | - | expression tag |
| His 388 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 44261.6 | |
| Non-Polymers* | Number of molecules | 5 |
| Total formula weight | 941.9 | |
| All* | Total formula weight | 45203.4 |
