Ab initio Quantum Mechanics/Molecular Mechanics Molecular Dynamics Simulation of CO in the Heme Distal Pocket of Myoglobin
Sign Up to like & getrecommendations! Published in 2017 at "Chinese Journal of Chemical Physics"
DOI: 10.1063/1674-0068/30/cjcp1709169
Abstract: Myoglobin has important biological functions in storing and transporting small diatomic molecules in human body. Two possible orientations of carbon monoxide (CO) in the heme distal pocket (named as B1 and B2 states) of myoglobin… read more here.
Keywords: mechanics molecular; distal pocket; heme distal; initio quantum ... See more keywords
A new inhibition mechanism in the multifunctional catalytic hemoglobin dehaloperoxidase as revealed by the DHP A(V59W) mutant: A spectroscopic and crystallographic study
Sign Up to like & getrecommendations! Published in 2021 at "Journal of Porphyrins and Phthalocyanines"
DOI: 10.1142/s1088424621500826
Abstract: As multifunctional catalytic hemoglobins, dehaloperoxidase isoenzymes A and B (DHP A and B) are among the most versatile hemoproteins in terms of activities displayed. The ability of DHP to bind over twenty different substrates in… read more here.
Keywords: dhp v59w; v59w; distal pocket; mechanism ... See more keywords