Table 2. Data collection and refinement statistics.
hGal1–LN1 | hGal3-CRD–LN1 | hGal7–LN1 | |
---|---|---|---|
Data collection | |||
Space group | P 212121 | P 212121 | P 212121 |
Cell dimensions | |||
a, b, c (Å) | 43.3, 58.2, 111.4 | 37.1, 57.6, 63.2 | 30.1, 55.4, 136.5 |
α, β, γ (°) | 90, 90, 90 | 90, 90, 90 | 90, 90, 90 |
Resolution (Å) | 30–1.93 (2–1.93) 1 | 30–2.208 (2.29–2.208) | 30–2.23 (2.31–2.23) |
I/s | 29.67 (7.11) | 38.35 (18.23) | 14.59 (6.21) |
Completeness (%) | 99.5 (96.4) | 99.47 (95.45) | 98.67 (96.45) |
Redundancy | 6.7 (6.3) | 7.7 (7.8) | 4.8 (4.7) |
R sym 2 | 0.056 (0.246) | 0.051 (0.132) | 0.050 (0.277) |
Refinement | |||
R work 3 / R free 4 | 0.196 / 0.235 | 0.165 / 0.203 | 0.196 / 0.225 |
B-factors (mean) | 34.40 | 32.00 | 30.00 |
r.m.s. deviations | |||
Bond lengths (Å) | 0.010 | 0.008 | 0.007 |
Bond angles (°) | 1.24 | 1.03 | 0.85 |
Ramachandran (%) | |||
Favored (%) | 97 | 99 | 98 |
Outliers (%) | 0 | 0 | 0 |
PDB ID code | 4XBL | 4XBN | 4XBQ |
1Statistics for data from the highest-resolution shell are shown in parentheses.
2 , where the average intensity <I> is taken overall symmetry equivalent measurements and I hkl is the measured intensity for any given reflection.
3 , where F o and F c are the observed and calculated structure factor amplitudes, respectively.
4 R free was calculated for R factor using only an unrefined subset of reflections data (5%).