4R68

Lactate Dehydrogenase in complex with inhibitor compound 31

Summary for 4R68

• Entry DOI: 10.2210/pdb4r68/pdb
• Related: 4R69
• Descriptor: L-lactate dehydrogenase A chain, 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ... (6 entities in total)
• Functional Keywords: oxidoreductase, nicotinamide adenine dinucleaotide
• Biological source: Homo sapiens (human)
• Cellular location: Cytoplasm: P00338
• Total number of polymer chains: 4
• Total formula weight: 152372.55

Authors

Eigenbrot, C.,Ultsch, M. (deposition date: 2014-08-22, release date: 2014-12-24, Last modification date: 2023-09-20)

• Primary citation: Labadie, S.,Dragovich, P.S.,Chen, J.,Fauber, B.P.,Boggs, J.,Corson, L.B.,Ding, C.Z.,Eigenbrot, C.,Ge, H.,Ho, Q.,Lai, K.W.,Ma, S.,Malek, S.,Peterson, D.,Purkey, H.E.,Robarge, K.,Salphati, L.,Sideris, S.,Ultsch, M.,VanderPorten, E.,Wei, B.,Xu, Q.,Yen, I.,Yue, Q.,Zhang, H.,Zhang, X.,Zhou, A.; Optimization of 5-(2,6-dichlorophenyl)-3-hydroxy-2-mercaptocyclohex-2-enones as potent inhibitors of human lactate dehydrogenase.; Bioorg.Med.Chem.Lett., 25:75-82, 2014; PubMed: 25466195; DOI: 10.1016/j.bmcl.2014.11.008

Experimental method

X-RAY DIFFRACTION (2.112 Å)