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[Preprint]. 2023 Mar 1:2023.03.01.530473. [Version 1] doi: 10.1101/2023.03.01.530473

Figure 7. Free energy surfaces of FbpC-C.

Figure 7.

A) Two-dimensional free energy surfaces were generated for FbpC-C. Two sets of K1 and K2 main chain and side chain distances are used as reaction coordinates for generating such surfaces. A) R248 and K345 with side chain distances defined using the Arg-CZ atom of R248 and the NZ atom of K345. B) Free energy surfaces generated for FbpC-C using H252 using between NE2 atom of H252 to measure the side chain distance. Representative conformations are shown for three energy minima for the most closed (green), most open (yellow), and median distances (cyan).