Table 1. Data Collection and Refinement Statistics.

	Ms0025	[Zn/Zn]-Ms0025
PDB entry	3MSR	3OVG
Data Collection
wavelength (Å)	0.9795	0.9795
resolution (Å)	2.16	2.06
outer shell resolution (Å)	2.28–2.16	2.13–2.06
space group	P6322	P1
cell dimensions
a, b, c (Å)	111.18, 111.18, 138.23	89.26, 89.19, 96.06
α, β, γ (deg)	90,0, 90.0, 120	98.25, 92.89, 119.86
no. of molecules per asymmetric unit	1	6
redundancy [overall (outermost shell)]	8.0 (7.9)	3.9 (3.9)
I/σ(I) [overall (outermost shell)]	15.4 (7.1)	11.77 (3.84)
Rmergea [overall (outermost shell)]	0.132 (0.49)	0.106 (0.347)
completeness (%) [overall (outermost shell)]	99.9 (98.3)	99.8 (96.3)
no. of reflections	27521	152064
Refinement
resolution range (Å)	50–2.16	50–2.06
no. of reflections	27521	151931
completeness (work + test) (%)	99.4	99.49
Rfactorb (%)	15.2	17.4
Rfreec (%)	19.2	21
no. of protein atoms	2789	16647
no. of water atoms	295	185
no. of ligand atoms	11	42
root-mean-square deviation for bonds (Å)	15.38	23.13
root-mean-square deviation for angles (deg)	0.02	0.01
Ramachandran plot analysis (%)
most favored region (additionally allowed)	94.83 (5.17)	95.43 (4.57)
disallowed region	0	0

^aR_merge = ∑_j|I_h – ⟨I_h|⟩/∑I_h, where ⟨I_h⟩ is the average intensity over symmetry equivalents.

^bR_factor = ∑|F_obs – F_calc|/∑|F_obs|.

^cR_free is the same as R_factor but for the test set.