Table 1. Data collection and refinement statistics for the PKAc–phospholamban (PLN) crystals.

Crystal	PKAc-WT PLN	PKAc-A11E PLN	PKAc-R9C PLN
λ for data collection (Å)	0.9795	0.9795	0.9795
Data collection
Space group	P 2 21 21	P 1 21 1	C 2 2 21
Cell dimension (Å)
a, b, c (Å)	52.57, 70.49, 99.03	49.56, 69.37, 56.24	50.91, 104.88, 168.10
α, β, γ (°)	90.00, 90.00, 90.00	90.00, 101.97, 90.00	90.00, 90.00, 90.00
Resolution	42.14–2.16	33.12–2.80	44.19–3.43
Rmerge	0.194 (0.907)	0.139 (0.527)	0.165 (0.738)
Average I/σ(I)	9.9 (1.8)	8.5 (1.8)	10.3 (2.5)
Completeness (%)	91.42 (68.22)	99.11 (94.08)	96.35 (95.02)
Redundancy	6.9 (6.1)	3.3 (3.1)	5.4 (5.7)
Refinement
Resolution (Å)	42.14–2.16	33.12–2.80	44.19–3.43
Highest resolution shells (Å)	2.24 (2.16)	2.78 (2.83)	3.56 (3.43)
No. of reflections	18,585	9242	6088
Average B-factor	30.88	37.93	95.81
Protein	30.52	37.97	95.92
Ligands	24.40	34.94	86.85
Water	36.01	37.30	–
R work	0.179 (0.230)	0.203 (0.294)	0.257 (0.339)
R free	0.227 (0.290)	0.252 (0.415)	0.317 (0.360)
RMSD length (Å)	0.008	0.002	0.001
RMSD angle (°)	1.20	0.490	0.370
No. of atoms
Protein	2780	2672	2775
Ligands	33	33	33
Water	238	23	0
Ramachandran plot (%)
Most favored	95.85	95.18	94.07
Additionally allowed	4.15	4.82	5.64