4P66

Electrostatics of Active Site Microenvironments of E. coli DHFR

Summary for 4P66

• Entry DOI: 10.2210/pdb4p66/pdb
• Related: 4P68
• Descriptor: Dihydrofolate reductase, METHOTREXATE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... (5 entities in total)
• Functional Keywords: oxidoreductase, catalysis, electrostatics, catalytic cycle
• Biological source: Escherichia coli
• Total number of polymer chains: 1
• Total formula weight: 19276.26

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: 2014-03-21, release date: 2014-07-16, Last modification date: 2023-11-15)

• 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; PubMed: 24977791; DOI: 10.1021/ja5038947

Experimental method

X-RAY DIFFRACTION (1.84 Å)