4I9U
Crystal structure of rabbit LDHA in complex with a fragment inhibitor AP26256
Summary for 4I9U
Entry DOI | 10.2210/pdb4i9u/pdb |
Related | 4I8X 4I9H 4I9N |
Descriptor | L-lactate dehydrogenase A chain, 6-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylic acid (3 entities in total) |
Functional Keywords | cancer, fragment, inhibitor, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor |
Biological source | Oryctolagus cuniculus (rabbit) |
Cellular location | Cytoplasm: P13491 |
Total number of polymer chains | 8 |
Total formula weight | 294673.34 |
Authors | Zhou, T.,Kohlmann, A.,Stephan, Z.G.,Commodore, L.,Greenfield, M.T.,Zhu, X.,Dalgarno, D.C. (deposition date: 2012-12-05, release date: 2013-01-23, Last modification date: 2023-09-20) |
Primary citation | Kohlmann, A.,Zech, S.G.,Li, F.,Zhou, T.,Squillace, R.M.,Commodore, L.,Greenfield, M.T.,Lu, X.,Miller, D.P.,Huang, W.S.,Qi, J.,Thomas, R.M.,Wang, Y.,Zhang, S.,Dodd, R.,Liu, S.,Xu, R.,Xu, Y.,Miret, J.J.,Rivera, V.,Clackson, T.,Shakespeare, W.C.,Zhu, X.,Dalgarno, D.C. Fragment growing and linking lead to novel nanomolar lactate dehydrogenase inhibitors. J.Med.Chem., 56:1023-1040, 2013 Cited by PubMed: 23302067DOI: 10.1021/jm3014844 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.5 Å) |
Structure validation
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