2ofu Summary details

pdbe.org/2ofu/summary_details
spacer x-ray crystal structure of 2-aminopyrimidine carbamate 43 bound to Lck
Summary
Header TRANSFERASEsearch
Method X-RAY DIFFRACTION
Experiment Resolution: 2.0 Å, R-factor: 22.8%, Free R-factor: 29.1%, Spacegroup: P 21 21 21
Released 27/02/2007, deposition: 04/01/2007, last revision: 24/02/2009
Authors Huang, X.search
Primary citation Novel 2-Aminopyrimidine Carbamates as Potent and Orally Active Inhibitors of Lck: Synthesis, SAR, and in Vivo Antiinflammatory Activity
J.MED.CHEM.search vol:49, pag:4981 (2006) [PubMed 16884310 ]search
Keywords Lcksearch, Kinase domainsearch, TRANSFERASEsearch
EC 2.7.10.2 ExPASy BRENDA search (A)
Organism Homo sapiens(human) 9606search(A)
UniProt P06239search (A)
Solvent A
Polymers
Chain Id Name Type UniProt Residues in sample sequence % of sample sequence observed
A Proto-oncogene tyrosine-protein kinase LCK Protein P06239 (LCK_HUMAN)search
273 100%
Heterogens
Chain Id Name Ligands
A SULFATE ION SO4 search
A 2,6-DIMETHYLPHENYL 2-(3,5-DIMETHOXY-4-(3-(4-METHYLPIPERAZIN-1-YL)PROPOXY)PHENYLAMINO)PYRIMIDIN- 4-YL(2,4-DIMETHOXYPHENYL)CARBAMATE 1N9 search
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