. 2016 Jan 7;6:18862. doi: 10.1038/srep18862

Table 1. Diffusion parameters extracted from fits by applying the SS jump model to fit Γ_T(Q ²) within Q = 0.2–1.0 and 0.2–1.8 Å⁻¹ ranges at 0.1 and 200 MPa.

Sample	Pressure/MPa	Diffusion parameters applying the SS jump model over Q-range indicated							τ_R/ps	ΔP/%
		Q-range: 0.2–1.0 Å⁻¹			Q-range: 0.2–1.8 Å⁻¹
		D_T×10⁻⁵/cm²s⁻¹	τ₀/ps	2W	D_T×10⁻⁵/cm²s⁻¹	τ₀/ps	2W	ΔP/%
Hydrogenated buffer (Hb)	0.1	—	—	—	2.70 ± 0.20	1.0 ± 0.10	0.01	−11	1.68 ± 0.06	+ 18
Hydrogenated buffer (Hb)	200	—	—	—	2.40 ± 0.19	1.22 ± 0.13	0.01		2.05 ± 0.09
Deuterated buffer (Db)	0.1	—	—	—	2.00 ± 0.11	1.02 ± 0.09	0.02	−9	1.80 ± 0.06	+ 10
Deuterated buffer (Db)	200	—	—	—	1.82 ± 0.20	1.15 ± 0.16	0.02		2.00 ± 0.09
Intracellular medium (Im) (Dc/Hb–Dc/Db)–Hb	0.1	—	—	—	2.43 ± 0.14	1.81 ± 0.07	0.05	−18	1.85 ± 0.10	+ 26
Intracellular medium (Im) (Dc/Hb–Dc/Db)–Hb	200	—	—	—	2.00 ± 0.12	2.00 ± 0.10	0.05		2.50 ± 0.09
[(Hc/Db)–Db]	0.1	2.12 ± 0.30	3.18 ± 0.21	0.17	2.57 ± 0.40	2.04 ± 0.10	0.07	−18	1.92 ± 0.12	+ 12
[(Hc/Db)–Db]	200	1.67 ± 0.40	3.71 ± 0.19	0.24	2.11 ± 0.30	2.11 ± 0.09	0.08		2.18 ± 0.10
[(Dc/Hb)–Hb]	0.1	2.12 ± 0.40	3.22 ± 0.26	0.17	2.45 ± 0.36	1.97 ± 0.25	0.07	−18	1.95 ± 0.09	+ 11
[(Dc/Hb)–Hb]	200	1.82 ± 0.30	3.46 ± 0.22	0.20	2.05 ± 0.30	2.13 ± 0.08	0.08		2.20 ± 0.09
[((H/D)–Im)–Db]	0.1	1.75 ± 0.36	2.27 ± 0.10	0.09	2.43 ± 0.24	1.89 ± 0.09	0.04	−20	—
[((H/D)–Im)–Db]	200	1.52 ± 0.38	2.45 ± 0.33	0.09	1.95 ± 0.30	2.15 ± 0.08	0.06		—
[((D/H)–Im)–Hb]	0.1	1.82 ± 0.25	2.21 ± 0.30	0.10	2.64 ± 0.36	2.01 ± 0.17	0.05	−21	—
[((D/H)–Im)–Hb]	200	1.52 ± 0.36	2.49 ± 0.27	0.11	2.10 ± 0.21	2.35 ± 0.12	0.05		—

The rotational relaxational time (τ_R) was extracted from the fit of the dynamic structure factor to the broad Lorentzian component.

Table 1. Diffusion parameters extracted from fits by applying the SS jump model to fit ΓT(Q 2) within Q = 0.2–1.0 and 0.2–1.8 Å−1 ranges at 0.1 and 200 MPa.