4B5D

Capitella teleta AChBP in complex with psychonicline (3-((2(S)- Azetidinyl)methoxy)-5-((1S,2R)-2-(2-hydroxyethyl)cyclopropyl)pyridine)

Summary for 4B5D

• Entry DOI: 10.2210/pdb4b5d/pdb
• Descriptor: CAPITELLA TELETA ACHBP, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-[(1R,2S)-2-[5-[[(2S)-azetidin-2-yl]methoxy]pyridin-3-yl]cyclopropyl]ethanol, ... (5 entities in total)
• Functional Keywords: acetylcholine-binding protein, nicotinic receptor, ion channel
• Biological source: CAPITELLA TELETA
• Total number of polymer chains: 5
• Total formula weight: 134908.82

Authors

Nys, M.,Ulens, C. (deposition date: 2012-08-03, release date: 2012-09-26, Last modification date: 2023-12-20)

• Primary citation: Zhang, H.,Eaton, J.B.,Yu, L.,Nys, M.,Mazzolari, A.,Van Elk, R.,Smit, A.B.,Alexandrov, V.,Hanania, T.,Sabath, E.,Fedolak, A.,Brunner, D.,Lukas, R.J.,Vistoli, G.,Ulens, C.,Kozikowski, A.P.; Insights Into the Structural Determinants Required for High- Affinity Binding of Chiral Cyclopropane-Containing Ligands to Alpha4Beta2-Nicotinic Acetylcholine Receptors: An Integrated Approach to Behaviorally Active Nicotinic Ligands.; J.Med.Chem., 55:8028-, 2012; PubMed: 22928944; DOI: 10.1021/JM3008739

Experimental method

X-RAY DIFFRACTION (2.195 Å)