Active Site Mapping of an Aspartic Protease by Multiple Fragment Crystal Structures: Versatile Warheads To Address a Catalytic Dyad-Reference-Cited by-同舟云学术

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Active Site Mapping of an Aspartic Protease by Multiple Fragment Crystal Structures: Versatile Warheads To Address a Catalytic Dyad

Published:2016-10-28 Issue:21 Volume:59 Page:9743-9759
ISSN:0022-2623
Container-title:Journal of Medicinal Chemistry
language:en
Short-container-title:J. Med. Chem.

Author:

Radeva Nedyalka¹,Schiebel Johannes¹,Wang Xiaojie¹,Krimmer Stefan G.¹,Fu Kan¹,Stieler Martin¹,Ehrmann Frederik R.¹,Metz Alexander¹,Rickmeyer Thomas¹,Betz Michael¹,Winquist Johan¹,Park Ah Young¹,Huschmann Franziska U.¹²,Weiss Manfred S.²,Mueller Uwe²³,Heine Andreas¹,Klebe Gerhard¹

Affiliation:

1. Department of Pharmaceutical Chemistry, Philipps University Marburg, Marbacher Weg 6, 35032 Marburg, Germany

2. Helmholtz-Zentrum Berlin für Materialien und Energie, Macromolecular Crystallography (HZB-MX), Albert-Einstein-Strasse 15, 12489 Berlin, Germany

3. MAX IV Laboratory, Lund University, Fotongatan 2, 225 94 Lund, Sweden

Funder

Bundesministerium für Bildung und Forschung

European Research Council

Publisher

American Chemical Society (ACS)

Subject

Drug Discovery,Molecular Medicine

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jmedchem.6b01195

Reference91 articles.

1. Fragment-based lead discovery

2. Fragment-Based Drug Discovery

3. Learning from our mistakes: The ‘unknown knowns’ in fragment screening

4. An Automated Microscale Thermophoresis Screening Approach for Fragment-Based Lead Discovery

5. Protein Thermal Shifts to Identify Low Molecular Weight Fragments

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