9CMZ
Crystal Structure of Cdk-related protein kinase 6 (PK6) from Plasmodium falciparum in complex with inhibitor KG2-051
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, B, C | Protein kinase 6 | polymer | 306 | 35847.4 | 3 | UniProt (Q8IDW1) Pfam (PF00069) In PDB | Plasmodium falciparum 3D7 | |
| 2 | A, B | CHLORIDE ION | non-polymer | 35.5 | 4 | Chemie (CL) | |||
| 3 | A, B, C | SULFATE ION | non-polymer | 96.1 | 3 | Chemie (SO4) | |||
| 4 | A, B, C | (4-{[5-chloro-4-(5-chlorothiophen-2-yl)pyrimidin-2-yl]amino}phenyl)[4-(pyrrolidin-1-yl)piperidin-1-yl]methanone | non-polymer | 502.5 | 3 | Chemie (A1AZE) | |||
| 5 | water | water | 18.0 | 26 | Chemie (HOH) |
Sequence modifications
A, B, C: 1 - 304 (UniProt: Q8IDW1)
| PDB | External Database | Details |
|---|---|---|
| Gly -1 | - | expression tag |
| Ser 0 | - | expression tag |
| Asn 44 | Cys 44 | engineered mutation |
| Arg 53 | Cys 53 | engineered mutation |
| Ala 86 | Lys 86 | engineered mutation |
| Asn 222 | Cys 222 | engineered mutation |
| Ala 237 | Lys 237 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 107542.1 | |
| Non-Polymers* | Number of molecules | 10 |
| Total formula weight | 1937.4 | |
| All* | Total formula weight | 109479.5 |
