Fig. 7: RDFs of amino acids with, and without, methyl groups in apo_h031. | Communications Chemistry

Fig. 7: RDFs of amino acids with, and without, methyl groups in apo_h031.

From: An experimentally representative in-silico protocol for dynamical studies of lyophilised and weakly hydrated amorphous proteins

Fig. 7

RDFs of amino acids with (CH3, dash dot orange line) and without (non-CH3, solid green line) methyl groups in apo_h031. The RDF of oxygen atoms of water molecules (h = 0.31) is also shown (dotted blue line). T = 290 K. The COM of the protein was chosen as the point of reference. Inset: the spatial grading, relative to the COM used in the main figure, projected onto the apo_h031 cavity.

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