. Author manuscript; available in PMC: 2020 Jun 30.

Published in final edited form as: Biochem Biophys Res Commun. 2019 May 12;514(3):974–978. doi: 10.1016/j.bbrc.2019.05.064

Table 1. Crystallographic Data Collection and Refinement Statistics.

(Values in parentheses are given for the highest resolution shell.).

	PR_Tri/GRL-1111
Space group	P2₁2₁2
Unit cell dimensions: (Å)
A	58.57
B	86.52
C	45.32
Resolution range (Final Shell)(Å)	50–1.50 (1.55–1.50)
Unique reflections	37,188 (2,865)
R_merge (%) overall (final shell)	5.9 (49.2)
I/σ(I) overall (final shell)	26.6 (3.1)
Completeness (%) overall (final shell)	96.8 (76.4)
Redundancy (final shell)	6.7 (4.1)
R (%)	13.4
R_free (%)	17.2
No. of solvent atoms	151
RMS deviation from ideality
Bonds (Å)	0.020
Angle distance (degree)	2.29
Average B-factors (A²)
Wilson B-factor	17.7
Main-chain atoms	17.0
Side-chain atoms	23.6
Inhibitor	15.7
Solvent	28.3