. 2009 Jul 13;284(39):26839–26850. doi: 10.1074/jbc.M109.003780

TABLE 2.

Model refinement statistics

Data set	Tgon077550AAB
Resolution (Å)	32.8–1.99
No. of reflections	23,178
No. of reflections in test set	1,186
R_work	0.165
R_free	0.206
RMSD bonds (Å)	0.01
RMSD angles (degrees)	1.16
Protein atoms	2,370
Non-protein atoms	174

Ramachandran statistics (%)^a
Residues in favored regions	96.6
Residues in allowed regions	100
Unmodeled residues^b	−11-0, 105p–107p, 183p–198p, 1
TLS groups (residues)^c	A: 2–15, 16–118, 119–135, 136–224; P: 108–123, 124–136, 137–168, 169–182
Mean B_iso + B_TLS protein atoms (Å²)	30.9
Mean B_iso non-protein atoms (Å²)	26.7
Protein Data Bank entry	3f75

^a Determined using the MolProbity Server (50).

^b Residues −11 to 0 are an N-terminal His tag and linker that replaced the first 104 propeptide residues of the full-length protein sequence (ToxoDB (39) accession number 645.m00037) during cloning.

^c Determined using the TLSMD server (30).