4P68

Electrostatics of Active Site Microenvironments for E. coli DHFR

Summary for 4P68

Entry DOI	10.2210/pdb4p68/pdb
Related	4P66
Descriptor	Dihydrofolate reductase, METHOTREXATE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... (6 entities in total)
Functional Keywords	electrostatics, catalysis, oxidoreductase, dhfr
Biological source	Escherichia coli
Total number of polymer chains	1
Total formula weight	19382.29
Authors	Liu, C.T.,Layfield, J.P.,Stewart III, R.J.,French, J.B.,Hanoian, P.,Asbury, J.B.,Hammes-Schiffer, S.,Benkovic, S.J. (deposition date: 2014-03-22, release date: 2014-07-16, Last modification date: 2023-12-27)
Primary citation	Liu, C.T.,Layfield, J.P.,Stewart, R.J.,French, J.B.,Hanoian, P.,Asbury, J.B.,Hammes-Schiffer, S.,Benkovic, S.J. Probing the electrostatics of active site microenvironments along the catalytic cycle for Escherichia coli dihydrofolate reductase. J.Am.Chem.Soc., 136:10349-10360, 2014 Cited by PubMed: 24977791 DOI: 10.1021/ja5038947 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.26 Å)

Structure validation