8BI6
Crystal structure of human Choline Kinase A in complex with UNC0638
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) | Choline kinase alpha | polymer | 457 | 52310.9 | 2 | UniProt (P35790) Pfam (PF01633) | Homo sapiens (human) | CK,CHETK-alpha,Ethanolamine kinase,EK |
| 2 | C, R (A, B) | MAGNESIUM ION | non-polymer | 24.3 | 2 | Chemie (MG) | |||
| 3 | D, S (A, B) | 2-cyclohexyl-6-methoxy-N-[1-(1-methylethyl)piperidin-4-yl]-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine | non-polymer | 509.7 | 2 | Chemie (CIQ) | |||
| 4 | E, F, G, H, I... (A, B) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 12 | Chemie (EDO) | |||
| 5 | L, M (A) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 2 | Chemie (PEG) | |||
| 6 | N, Y (A, B) | ISOPROPYL ALCOHOL | non-polymer | 60.1 | 2 | Chemie (IPA) | |||
| 7 | AA, BA, O, Z (B, A) | PHOSPHATE ION | non-polymer | 95.0 | 4 | Chemie (PO4) | |||
| 8 | CA, P, Q (B, A) | CHLORIDE ION | non-polymer | 35.5 | 3 | Chemie (CL) | |||
| 9 | DA, EA (A, B) | water | water | 18.0 | 396 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 104621.7 | |
| Non-Polymers* | Number of molecules | 27 |
| Total formula weight | 2631.6 | |
| All* | Total formula weight | 107253.3 |
