4E1E

Crystal structure of Trypanosome cruzi farnesyl diphosphate synthase in complex with [2-(n-hexylamino)ethane-1,1-diyl]bisphosphonic acid and Mg2+

Summary for 4E1E

Entry DOI	10.2210/pdb4e1e/pdb
Related	1YHK 1YHL 1YHM 3IBA 3ICK 3ICM 3ICN 3ICZ 4DWB 4DWG 4DXJ 4DZW
Descriptor	Farnesyl pyrophosphate synthase, MAGNESIUM ION, [2-(hexylamino)ethane-1,1-diyl]bis(phosphonic acid), ... (6 entities in total)
Functional Keywords	geranyl transferase, farnesyl pyrophosphate synthase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Trypanosoma cruzi
Total number of polymer chains	1
Total formula weight	41725.33
Authors	Aripirala, S.,Amzel, L.M.,Gabelli, S.B. (deposition date: 2012-03-06, release date: 2013-01-16, Last modification date: 2023-09-13)
Primary citation	Aripirala, S.,Szajnman, S.H.,Jakoncic, J.,Rodriguez, J.B.,Docampo, R.,Gabelli, S.B.,Amzel, L.M. Design, synthesis, calorimetry, and crystallographic analysis of 2-alkylaminoethyl-1,1-bisphosphonates as inhibitors of Trypanosoma cruzi farnesyl diphosphate synthase. J.Med.Chem., 55:6445-6454, 2012 Cited by PubMed: 22715997 DOI: 10.1021/jm300425y PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.65 Å)

Structure validation