Table 1. Data-collection statistics for BGlu1 and BGlu1 with inhibitor.
BGlu1 | BGlu1 with DNP2FG | |
---|---|---|
Wavelength (Å) | 1.5418 | 1.5418 |
Resolution (Å) | 55.72–2.75 (2.85–2.75) | 53.82–2.15(2.23–2.15) |
Completeness (%) | 99.5 (99.9) | 96.5 (83.1) |
Rmerge (%) | 14.6 (35.4) | 11.0 (30.7) |
〈I/σ(I)〉 | 3.6 (1.6) | 4.3 (1.8) |
Mosaicity (°) | 0.660 | 0.670 |
Space group | P212121 | P212121 |
Unit-cell parameters (Å) | a = 78.854, b = 100.337, c = 127.097 | a = 79.369, b = 100.922, c = 127.229 |
Unit-cell volume (Å3) | 1005589.7 | 1019114.5 |
No. of unique reflections | 50449 (5078) | 103691 (8925) |
No. of observed reflections | 97594 (9650) | 213255 (13611) |
VM (Å3 Da−1) | 2.5 | 2.5 |
Solvent content (%) | 50.7 | 51.3 |
No. of molecules per ASU | 2 | 2 |