7VBX
Crystal structure of human pyruvate dehydrogenase kinase 2 in complex with compound 20
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial | polymer | 394 | 44647.7 | 1 | UniProt (Q15119) Pfam (PF10436) Pfam (PF02518) | Homo sapiens (Human) | Pyruvate dehydrogenase kinase isoform 2,PDH kinase 2,PDKII |
| 2 | B (A) | CHLORIDE ION | non-polymer | 35.5 | 1 | Chemie (CL) | |||
| 3 | C (A) | ACETATE ION | non-polymer | 59.0 | 1 | Chemie (ACT) | |||
| 4 | D, E (A) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 2 | Chemie (DMS) | |||
| 5 | F (A) | (3~{S})-3-[5-(8-cyclopropyl-2-methyl-9~{H}-pyrido[2,3-b]indol-3-yl)-1,3,4-oxadiazol-2-yl]-4-methyl-~{N}-[(1~{R})-1-phenylethyl]pentanamide | non-polymer | 507.6 | 1 | Chemie (5ZP) | |||
| 6 | G (A) | water | water | 18.0 | 56 | Chemie (HOH) |
Sequence modifications
A: 16 - 407 (UniProt: Q15119)
| PDB | External Database | Details |
|---|---|---|
| Gly 14 | - | expression tag |
| Ser 15 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 44647.7 | |
| Non-Polymers* | Number of molecules | 5 |
| Total formula weight | 758.4 | |
| All* | Total formula weight | 45406.1 |
