Skip to main content

View full-text article in PMC

. 2018 Mar 21;6:e4552. doi: 10.7717/peerj.4552

Table 1. Crystallographic data collection and refinement statistics.

	H_C/FA	H_C/A1 (crystal form 1)	H_C/A1 (crystal form 2)
Space Group	P422	P2₁2₁2₁	P2₁
Cell dimensions
a, b, c (Å)	118.0, 118.0, 173.8	39.8, 107.3, 107.6	61.4, 53.9, 62.7
α, β, γ (°C)	90.0, 90.0, 90.0	90.0, 90.0, 90.0	90.0, 106.1, 90.0
Resolution (Å)	24.40–1.95 (1.98–1.95)^a	24.10–1.45 (1.48–1.45)^a	60.24–1.80 (1.84–1.80)^a
R_merge (%)	20.1 (168.6)^a	7.6 (69.2)^a	14.2 (53.9)^a
R_meas (%)	20.8 (176.0)^a	9.7 (92.0)^a	15.0 (58.8)^a
R_pim (%)	5.6 (50.2)^a	5.8 (60.1)^a	4.6 (22.5)^a
CC1/2	0.999 (0.832)^a	0.997 (0.357)^a	0.962 (0.954)^a
<I/σ(I)>	12.6 (2.3)^a	6.9 (1.3)^a	14.4 (3.7)^a
Completeness (%)	100.0 (100.0)^a	95.3 (95.1)^a	98.6 (89.1)^a
Multiplicity	26.0 (23.7)^a	3.3 (2.7)^a	20.4 (11.7)^a
R_work (%)	18.0	17.6	18.8
R_free (%)	20.9	22.1	22.3
No. of atoms
Protein	6,907	3,511	3,263
Water	609	421	322
RMSD bond length (Å)	0.007	0.002	0.005
RMSD bond angle (°)	0.89	0.44	0.73
Wilson B factor (Å²)	24.6	15.9	13.4
Average B factors (Å²)
Protein	28.2, 30.0	21.2	22.5
Solvent	33.8	34.1	28.0
Ramachandran plot
Favoured (%)	96.7	96.3	96.4
Allowed (%)	3.4	3.5	3.6
Disallowed (%)	0.0	0.2	0.0
PDB code	5MK8	5MK6	5MK7

Notes.

^a

Values in parentheses are for the highest resolution shell.