3IE3

Structural basis for the binding of the anti-cancer compound 6-(7-Nitro-2,1,3-benzoxadiazol-4-ylthio)hexanol (NBDHEX) to human glutathione S-transferases

Summary for 3IE3

• Entry DOI: 10.2210/pdb3ie3/pdb
• Related: 3GUR 3GUS
• Descriptor: Glutathione S-transferase P, GLUTATHIONE, 6-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]hexan-1-ol, ... (5 entities in total)
• Functional Keywords: detoxification, multidrug resistance, cancer treatment, phosphoprotein, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 48008.76

Authors

Federici, L.,Lo Sterzo, C.,Di Matteo, A.,Scaloni, F.,Federici, G.,Caccuri, A.M. (deposition date: 2009-07-22, release date: 2009-10-27, Last modification date: 2023-11-01)

• Primary citation: Federici, L.,Lo Sterzo, C.,Pezzola, S.,Di Matteo, A.,Scaloni, F.,Federici, G.,Caccuri, A.M.; Structural basis for the binding of the anticancer compound 6-(7-nitro-2,1,3-benzoxadiazol-4-ylthio)hexanol to human glutathione s-transferases; Cancer Res., 69:8025-8034, 2009; PubMed: 19808963; DOI: 10.1158/0008-5472.CAN-09-1314

Experimental method

X-RAY DIFFRACTION (1.8 Å)