4JX7-B-A

PDB Title 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
Resolution (Å) 2.400
Classification TRANSFERASE/TRANSFERASE INHIBITOR

Protein

Description Serine/threonine-protein kinase pim-1
Organism Homo sapiens
Chain A
Length 275
Binding Area (Å2) 354.80
Molecular Weight -
Aromaticity 0.10
Instability -
Isoelectric Point 5.29
Sequence PLESQYQVGPLLGSGGFGSVYSGIRVSDNLPVAIKHVEKDRISDWGELPNGTRVPMEVVLLKKVSSGFSGVIRLLDWFERPDSFVLILERPEPVQDLFDFITERGALQEELARSFFWQVLEAVRHCHNCGVLHRDIKDENILIDLNRGELKLIDFGSGALLKDTVYTDFDGTRVYSPPEWIRYHRYHGRSAAVWSLGILLYDMVCGDIPFEHDEEIIRGQVFFRQRVSSECQHLIRWCLALRPSDRPTFEEIQNHPWMQDVLLPQETAEIHLHSX

Peptide

Description PIM1 consensus peptide
Organism Escherichia coli
Chain B
Length 5
Binding Area (Å2) 454.61
Hydrophobic (% a.a.)
0%
Molecular Weight 751.88
Aromaticity 0.00
Instability 340.84
Isoelectric Point 12.30
Sequence KRRRH

Clustering Classification

Sequence cluster S 217
Contact cluster C17
Interface cluster I17