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4AL4

rat LDHA in complex with 2-((4-(2-((3-((2-methyl-1,3-benzothiazol-6- yl)amino)3-oxo-propyl)carbamoylamino)ethoxy)phenyl)methylpropanedioic acid

Summary for 4AL4
Entry DOI10.2210/pdb4al4/pdb
Related4AJ1 4AJ2 4AJ4 4AJE 4AJH 4AJI 4AJJ 4AJK 4AJL 4AJN 4AJO
DescriptorL-LACTATE DEHYDROGENASE A CHAIN, GLYCEROL, 2-[[4-[2-[[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxidanylidene-propyl]carbamoylamino]ethoxy]phenyl]methyl]propanedioic acid, ... (4 entities in total)
Functional Keywordsoxidoreductase-inhibitor complex, fragment based lead generated inhibitors, oxidoreductase/inhibitor
Biological sourceRATTUS NORVEGICUS (NORWAY RAT)
Cellular locationCytoplasm: P04642
Total number of polymer chains4
Total formula weight149146.90
Authors
Tucker, J.A.,Brassington, C.,Hassall, G.,Ward, R.,Tart, J.,Davies, G.,Hohson, M.,Pearson, S. (deposition date: 2012-03-01, release date: 2012-03-21, Last modification date: 2012-04-25)
Primary citationWard, R.,Brassington, C.,Breeze, A.L.,Caputo, A.,Critchlow, S.,Davies, G.,Goodwin, L.,Hassall, G.,Greenwood, R.,Holdgate, G.,Mrosek, M.,Norman, R.A.,Pearson, S.,Tart, J.,Tucker, J.A.,Vogtherr, M.,Whittaker, D.,Wingfield, J.,Winter, J.,Hudson, K.
The Design and Synthesis of Novel Lactate Dehydrogenase a Inhibitors by Fragment-Based Lead Generation
J.Med.Chem., 55:3285-, 2012
Cited by
PubMed: 22417091
DOI: 10.1021/JM201734R
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.78 Å)
Structure validation

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