. Author manuscript; available in PMC: 2008 Aug 19.

Published in final edited form as: Biochemistry. 2007 Jan 23;46(3):659–668. doi: 10.1021/bi061515r

Table 1.

Data processing and refinement statistics.

	TvPNP-ImmA	TvPNP-DADMe-ImmA
Wavelength (Å)	0.979301	0.979099
Resolution (Å)	2.7	2.7
Unique Reflections	37032	50207
Completeness (%)^a	99.3 (99.5)	98.1 (93.8)
Multiplicity^a	6.2	6.9
R_sym (%)^a, ^b	6.9 (41.8)	11.6 (59.4)
I/σ^a	17 (3)	11.4 (1.7)
No. of protein atoms	5242	10721
No. of water molecules	73	170
R-factor	17.0	19.9
R_free	22.5	25.1
Average B-factor	60	37.8
R.m.s bond (Å)	0.02	0.01
R.m.s angle (Å)	1.5	1.3
Ramachandran analysis
Most favored	83.5%	84.5%
Allowed	16.0%	15.2%
Disallowed	0.5%	0.3%

Values for the highest resolution shell are given in parentheses.

R_sym= (Σ_hklΣ_i|I_i(hkl) - <I(hkl)>|) / Σ_hklΣ_iI_i(hkl) for n independent reflections and observations of a given reflection, <I(hkl)> is the average intensity of the i observation.