4JX7
Crystal structure of Pim1 kinase in complex with inhibitor 2-[(trans-4-aminocyclohexyl)amino]-4-{[3-(trifluoromethyl)phenyl]amino}pyrido[4,3-d]pyrimidin-5(6H)-one
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Serine/threonine-protein kinase pim-1 | polymer | 326 | 37293.4 | 1 | UniProt (P11309) Pfam (PF00069) In PDB | Homo sapiens (human) | Pim1 kinase |
2 | B | PIM1 consensus peptide | polymer | 14 | 1592.8 | 1 | Escherichia coli | ||
3 | A | 2-[(trans-4-aminocyclohexyl)amino]-4-{[3-(trifluoromethyl)phenyl]amino}pyrido[4,3-d]pyrimidin-5(6H)-one | non-polymer | 418.4 | 1 | Chemie (1N6) | |||
4 | water | water | 18.0 | 104 | Chemie (HOH) |
Sequence modifications
A: 1 - 313 (UniProt: P11309)
PDB | External Database | Details |
---|---|---|
Ala 314 | - | expression tag |
Ala 315 | - | expression tag |
Ala 316 | - | expression tag |
Leu 317 | - | expression tag |
Glu 318 | - | expression tag |
His 319 | - | expression tag |
His 320 | - | expression tag |
His 321 | - | expression tag |
His 322 | - | expression tag |
His 323 | - | expression tag |
His 324 | - | expression tag |
His 325 | - | expression tag |
His 326 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 38886.3 | |
Non-Polymers* | Number of molecules | 1 |
Total formula weight | 418.4 | |
All* | Total formula weight | 39304.7 |