4BDJ

Fragment-based screening identifies a new area for inhibitor binding to checkpoint kinase 2 (CHK2)

Summary for 4BDJ

Entry DOI	10.2210/pdb4bdj/pdb
Related	1GXC 2CN5 2CN8 2W0J 2W7X 2WTC 2WTD 2WTI 2WTJ 2XBJ 2XK9 2XM8 2XM9 2YCF 2YCQ 2YCR 2YCS 2YIQ 2YIR 2YIT 4A9R 4A9S 4A9T 4A9U 4BDA 4BDB 4BDC 4BDD 4BDE 4BDF 4BDG 4BDH 4BDI 4BDK
Descriptor	CHECKPOINT KINASE 2, 3-cyclopropyl-4-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridine, NITRATE ION, ... (4 entities in total)
Functional Keywords	transferase
Biological source	HOMO SAPIENS (HUMAN)
Cellular location	Isoform 2: Nucleus. Isoform 4: Nucleus. Isoform 7: Nucleus. Isoform 9: Nucleus. Isoform 12: Nucleus. Nucleus, PML body: O96017
Total number of polymer chains	1
Total formula weight	37399.09
Authors	Silva-Santisteban, M.C.,Westwood, I.M.,Boxall, K.,Brown, N.,Peacock, S.,McAndrew, C.,Barrie, E.,Richards, M.,Mirza, A.,Oliver, A.W.,Burke, R.,Hoelder, S.,Jones, K.,Aherne, G.W.,Blagg, J.,Collins, I.,Garrett, M.D.,van Montfort, R.L.M. (deposition date: 2012-10-05, release date: 2013-06-26, Last modification date: 2023-12-20)
Primary citation	Silva-Santisteban, M.C.,Westwood, I.M.,Boxall, K.,Brown, N.,Peacock, S.,Mcandrew, C.,Barrie, E.,Richards, M.,Mirza, A.,Oliver, A.W.,Burke, R.,Hoelder, S.,Jones, K.,Aherne, G.W.,Blagg, J.,Collins, I.,Garrett, M.D.,Van Montfort, R.L.M. Fragment-Based Screening Maps Inhibitor Interactions in the ATP-Binding Site of Checkpoint Kinase 2. Plos One, 8:65689-, 2013 Cited by PubMed: 23776527 DOI: 10.1371/JOURNAL.PONE.0065689 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (3.01 Å)

Structure validation