4AXA
Structure of PKA-PKB chimera complexed with (1S)-2-amino-1-(4- chlorophenyl)-1-(4-(1H-pyrazol-4-yl)phenyl)ethan-1-ol
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | CAMP-DEPENDENT PROTEIN KINASE CATALYTIC SUBUNIT ALPHA | polymer | 351 | 40830.6 | 1 | UniProt (P00517) Pfam (PF00069) | BOS TAURUS (CATTLE) | PKA C-ALPHA |
| 2 | B (I) | CAMP-DEPENDENT PROTEIN KINASE INHIBITOR ALPHA | polymer | 20 | 2226.4 | 1 | UniProt (P61925) | HOMO SAPIENS | PKI-ALPHA, CAMP-DEPENDENT PROTEIN KINASE INHIBITOR, MUSCLE/BRAIN ISOFORM |
| 3 | C (A) | (2S)-2-(4-chlorophenyl)-2-hydroxy-2-[4-(1H-pyrazol-4-yl)phenyl]ethanaminium | non-polymer | 314.8 | 1 | Chemie (RKD) | |||
| 4 | D, E (A, I) | water | water | 18.0 | 328 | Chemie (HOH) |
Sequence modifications
A: 0 - 350 (UniProt: P00517)
| PDB | External Database | Details |
|---|---|---|
| Thr 104 | Val 105 | engineered mutation |
| Ala 123 | Val 124 | engineered mutation |
| Met 173 | Leu 174 | engineered mutation |
| Lys 181 | Gln 182 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 43057.0 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 314.8 | |
| All* | Total formula weight | 43371.8 |
