Table 1. Refinement statistics for the aldolase system.

	CDMD	Phenix	Rosetta	Refmac
FSCavg (full map)	0.774	0.704	0.790	0.778
EMRinger	4.48	2.64	4.90	1.31
Bond lengths (Å)	0.022	0.006	0.022	0.012
Bond angles (°)	2.22	1.30	1.76	2.90
MolProbity	1.15	1.49	0.61	3.57
All-atom clashscore	0.24	3.82	0.28	31.6
Ramachandran statistics:
Favored (%)	96.41	100.0	98.17	93.33
Allowed (%)	2.79	0.0	1.76	5.06
Outliers (%)	0.81	0.0	0.07	1.61
Poor rotamers (%)	2.61	2.61	0.09	32.6
CaBLAM flagged (%)	9.0	10.1	8.32	13.3