3SPF

Crystal Structure of Bcl-xL bound to BM501

Summary for 3SPF

• Entry DOI: 10.2210/pdb3spf/pdb
• Related: 3SP7
• Descriptor: Bcl-2-like protein 1, 4-(4-chlorophenyl)-1-[(3S)-3,4-dihydroxybutyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-3-phenyl-1H-pyrrole-2-carboxamide, GLYCEROL, ... (4 entities in total)
• Functional Keywords: bcl-2-like protein, apoptosis-apoptosis inhibitor complex, apoptosis regulator-inhibitor complex, apoptosis regulator/inhibitor
• Biological source: Homo sapiens (Human); More
• Cellular location: Isoform Bcl-X(L): Mitochondrion inner membrane : Q07817
• Total number of polymer chains: 1
• Total formula weight: 20570.04

Authors

Meagher, J.L.,Stuckey, J.A. (deposition date: 2011-07-01, release date: 2012-06-27, Last modification date: 2024-02-28)

• Primary citation: Zhou, H.,Chen, J.,Meagher, J.L.,Yang, C.Y.,Aguilar, A.,Liu, L.,Bai, L.,Cong, X.,Cai, Q.,Fang, X.,Stuckey, J.A.,Wang, S.; Design of Bcl-2 and Bcl-xL Inhibitors with Subnanomolar Binding Affinities Based upon a New Scaffold.; J.Med.Chem., 55:4664-4682, 2012; PubMed: 22448988; DOI: 10.1021/jm300178u

Experimental method

X-RAY DIFFRACTION (1.7 Å)