Table 1. Crystallographic data collection and refinement statistics.
MsVps4ΔMIT | ADP/MsVps4ΔL-MIT | ADP/MsVps4ΔMIT | |
---|---|---|---|
Data collection | |||
Space group | P212121 | P65 | P65 |
Cell dimensions | |||
a, b, c (Å) | 99.70, 127.39, 191.23 | 65.27, 65.27, 112.5 | 151.19, 151.19, 98.59 |
α, β, γ (°) | 90, 90, 90 | 90, 90, 120 | 90, 90, 120 |
Resolution (Å) | 48–3.6 (3.8–3.6)* | 2.4 (2.49–2.40)* | 3.2 (3.4–3.2)* |
Rmerge | 9.1 (61.6) | 5.8 (63.1) | 14.4 (51) |
I/σI | 8.31 (1.76) | 16.7 (2.3) | 9.9 (3.1) |
Completeness (%) | 99.1 (99.6) | 99.7 (99.7) | 99.6 (99.8) |
Redundancy | 5.3 (5.5) | 4.1 (4.2) | 4.6 (4.7) |
Refinement | |||
Resolution (Å) | 3.6 | 2.4 | 3.2 |
No. reflections | 27,368 | 10,642 | 21,217 |
Rwork/Rfree | 26.4/31.8 | 21.2/26.4 | 22.9/26.8 |
No. atoms | |||
Protein | 12,875 | 2,133 | 6,528 |
Ligand/ion | 0 | 27 | 81 |
Water | 0 | 7 | 12 |
B-factors | |||
Protein | 142.61 | 55.8 | 53.5 |
Ligand/ion | 43.1 | 43.1 | |
Water | 41.7 | 21.2 | |
Root mean squared deviations | |||
Bond lengths (Å) | 0.01 | 0.013 | 0.011 |
Bond angles (°) | 1.716 | 1.59 | 1.54 |
One crystal was used for each structure. *Highest resolution shell is shown in parenthesis.