From owner-chemistry@ccl.net Wed Feb 2 07:56:01 2011 From: "John john|-|ccdc.cam.ac.uk" To: CCL Subject: CCL: FW: How to get 3D structures of FDA approved drugs Message-Id: <-43830-110202052657-8337-c1PLnQheUq39p9dpi+QvIQ .. server.ccl.net> X-Original-From: "John" Content-Language: en-gb Content-Transfer-Encoding: 7bit Content-Type: text/plain; charset="US-ASCII" Date: Wed, 2 Feb 2011 10:26:38 -0000 MIME-Version: 1.0 Sent to CCL by: "John" [john**ccdc.cam.ac.uk] Dear Anup, If you have a literature reference to the crystal structure determination of a drug molecule you are interested in, you can download the structure as deposited by the authors, from http://www.ccdc.cam.ac.uk/products/csd/request/. You will need the CCDC Deposition number which can be found in the literature reference. Some 3D structures of well known drugs are also accessible from the CCDC Teaching Dataset. These can be best accessed by searching for the drug of interest using Chemspider (http://www.chemspider.com) and then, via the Xtal Structures tab of the entry of interest, accessing and downloading the relevant structure. If you are able to access the Cambridge Structural Database (CSD) > from your institution we could provide you with a list of CSD refcodes to 3D structures of FDA approved compounds that we've compiled. Anyone interested in accessing this list should contact CCDC at support : ccdc.cam.ac.uk. Should you need further information on how to access the CSD, please visit http://www.ccdc.cam.ac.uk or e-mail admin : ccdc.cam.ac.uk John -----Original Message----- > From: owner-chemistry+ccdc-announce==ccdc.cam.ac.uk : ccl.net [mailto:owner-chemistry+ccdc-announce==ccdc.cam.ac.uk : ccl.net] On Behalf Of Anup Shah shahanup86#gmail.com Sent: 27 January 2011 04:47 To: Rutland, Anne Subject: CCL: How to get 3D structures of FDA approved drugs Sent to CCL by: "Anup Shah" [shahanup86%x%gmail.com] Hello all, Can anybody suggest any source from which we can download 3D structures or crystal structures of FDA approved drugs? Thanking you in anticipation Regards Anup Shah IGIB, New Delhi, Indiahttp://www.ccl.net/cgi-bin/ccl/send_ccl_messagehttp://www.ccl.net/chemistry/sub_unsub.shtmlhttp://www.ccl.net/spammers.txtLEGAL NOTICE Unless expressly stated otherwise, information contained in this message is confidential. If this message is not intended for you, please inform postmaster : ccdc.cam.ac.uk and delete the message. The Cambridge Crystallographic Data Centre is a company Limited by Guarantee and a Registered Charity. Registered in England No. 2155347 Registered Charity No. 800579 Registered office 12 Union Road, Cambridge CB2 1EZ.