Skip to main content
. 2003 Apr;84(4):2474–2482. doi: 10.1016/S0006-3495(03)75052-8

TABLE 1.

Crystal parameters, data collection, and refinement statistics

Illuminated state
Complex Dark state LOV1-447 Dataset of a single crystal Composite dataset of LOV1-390
PDB code 1N9L 1N9N 1N9O
 Crystal parameters: P6522 unit cell (a = b, c), Å 122.1, 46.1 120.9, 46.0 121.9, 45.5
Data collection
 Beamline (ESRF, Grenoble) ID14-4 ID29 ID29, ID14-4
 Wavelength, Å 0.9393 0.969 0.969/0.939
Data statistics
 Resolution, Å 15.0–1.9 15.0–2.3 15.0–2.8
 No. of observations/unique reflections 77,830/16142 69,773/9184 16,983/5009
 Completeness (total/high) [%]* 98.0/96.6 99.5/99.9 95.2/82.5
I/σ(I) (total/high)* 12.8/3.5 12.6/4.6 7.5/2.6
Rsym,(total/high)* 6.8/35.1 13.2/43.1 12.9/32.2
Refinement statistics
 Resolution range, Å 15.0–1.9 15.0–2.3 15.0–2.8
 Included amino acids 17–125 18–125 18–125
 No. of protein atoms 844 834 834
 No. of waters 108 114 26
 No. of SO42− ions 1 0 1
Rwork, Rfree, % 23.2/24.8 21.2/26.5 25.0/29.8
 Root-mean square deviation for bonds/angles, Å/degrees 0.008/1.28 0.008/1.34 0.009/1.32
*

Completeness, Rsym, and I/σ(I) are given for all data and for the highest resolution shell: dark, 1.9–2.0 Å; illuminated 1, 2.3–2.4 Å; composite dataset, 2.8–2.9 Å.

Rsym = ∑|I − 〈I〉|/∑I.

Rwork = ∑|Fobs| − k|Fcalc|/∑|Fobs|.

5% of randomly chosen reflections were used.