2YIT

Structural analysis of checkpoint kinase 2 in complex with PV1162, a novel inhibitor

Summary for 2YIT

• Entry DOI: 10.2210/pdb2yit/pdb
• Related: 1GXC 2CN5 2CN8 2W0J 2W7X 2WTC 2WTD 2WTI 2WTJ 2XBJ 2XM8 2XM9 2YCF 2YCQ 2YCR 2YCS 2YIQ 2YIR
• Descriptor: SERINE/THREONINE-PROTEIN KINASE CHK2, N-{4-[(1E)-N-carbamimidoylbutanehydrazonoyl]phenyl}-5-methoxy-1H-indole-2-carboxamide, NITRATE ION, ... (4 entities in total)
• Functional Keywords: transferase, structure-based drug design, cell cycle
• 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: 37016.70

Authors

Lountos, G.T.,Jobson, A.G.,Tropea, J.E.,Self, C.,Zhang, G.,Pommier, Y.,Shoemaker, R.H.,Waugh, D.S. (deposition date: 2011-05-16, release date: 2011-09-07, Last modification date: 2023-12-20)

• Primary citation: Lountos, G.T.,Jobson, A.G.,Tropea, J.E.,Self, C.R.,Zhang, G.,Pommier, Y.,Shoemaker, R.H.,Waugh, D.S.; X-Ray Structures of Checkpoint Kinase 2 in Complex with Inhibitors that Target its Gatekeeper-Dependent Hydrophobic Pocket.; FEBS Lett., 585:3245-, 2011; PubMed: 21907711; DOI: 10.1016/J.FEBSLET.2011.08.050

Experimental method

X-RAY DIFFRACTION (2.2 Å)