TABLE 1.
Crystallographic data collection and refinement statistics
Enzyme complex | hUXS1-UDP-NAD+ |
---|---|
PDB accession code | 2B69 |
Synchrotron beamline | SLS, X10SA |
Wavelength (Å) | 0.9795 |
Space group | P121 |
Unit cell dimensions | a = 46, b = 45, c = 85 Å |
α = γ = 90.0° | |
β = 97° | |
Resolution rangea (Å) | 42–1.20 (1.26–1.20) |
No. unique reflectionsa | 93023 (8576) |
Completenessa (%) | 91.3 (58.1) |
Mean I/sdI 〈I/σ(I)〉a | 25.2 (1.3) |
Rmergea (%) | 6.5 (53.7) |
Redundancya | 2.1 (1.3) |
Refinement | |
No. atoms P/L/Ob | 2439/94/353 |
Rwork/Rfree (%) | 13.4/16.2 |
R.m.s. deviation bond lengthc (Å) | 0.014 |
R.m.s. deviation bond angle (°) | 1.506 |
Bmean P/L/Ob (Å2) | 14/28/32 |
a Values in parentheses correspond to data in highest resolution shell.
b P/L/O refer to protein, ligand, and solvent atoms.
c R.m.s. deviation is root mean square deviation.