3PYY
Discovery and Characterization of a Cell-Permeable, Small-molecule c-Abl Kinase Activator that Binds to the Myristoyl Binding Site
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | V-abl Abelson murine leukemia viral oncogene homolog 1 isoform b variant | polymer | 298 | 34708.6 | 2 | UniProt (Q59FK4) Pfam (PF07714) UniProt (by SIFTS) (P00519) In PDB | Homo sapiens (human) | |
2 | A, B | SULFATE ION | non-polymer | 96.1 | 3 | Chemie (SO4) | |||
3 | A, B | 4-(4-METHYL-PIPERAZIN-1-YLMETHYL)-N-[4-METHYL-3-(4-PYRIDIN-3-YL-PYRIMIDIN-2-YLAMINO)-PHENYL]-BENZAMIDE | non-polymer | 493.6 | 2 | Chemie (STI) | |||
4 | A, B | (5R)-5-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]imidazolidine-2,4-dione | non-polymer | 336.3 | 2 | Chemie (3YY) | |||
5 | B | NONAETHYLENE GLYCOL | non-polymer | 414.5 | 1 | Chemie (2PE) | |||
6 | B | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
7 | water | water | 18.0 | 215 | Chemie (HOH) |
Sequence modifications
A, B: 248 - 531 (UniProt: Q59FK4)
PDB | External Database | Details |
---|---|---|
Met 234 | - | expression tag |
His 235 | - | expression tag |
His 236 | - | expression tag |
His 237 | - | expression tag |
His 238 | - | expression tag |
His 239 | - | expression tag |
His 240 | - | expression tag |
Glu 241 | - | expression tag |
Asn 242 | - | expression tag |
Leu 243 | - | expression tag |
Tyr 244 | - | expression tag |
Phe 245 | - | expression tag |
Gln 246 | - | expression tag |
Gly 247 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 69417.1 | |
Non-Polymers* | Number of molecules | 9 |
Total formula weight | 2454.6 | |
All* | Total formula weight | 71871.7 |