|
Refinement statistics for vvUDG. |
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| PDB ID |
Trigonal (Native I) 2OWQ |
Orthorhombic (Native II) 2OWR |
|
|
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| Resolution [Å] |
19.27–2.40 (2.46–2.40) |
20.00–2.30 (2.36–2.30) |
| No. of Reflections |
21956 (1699) |
93107 (7120) |
| Completeness [%] |
98.4 (99.7) |
99.9 (99.9) |
| Rall [%] |
24.4 |
25.5 |
| Rwork [%] |
24.1 (29.5) |
25.3 (28.3) |
| Rfree [%] |
29.9 (35.5) |
30.2 (38.0) |
| No. of Atoms |
||
| Overall |
3725 |
14550 |
| Protein |
3534 |
13838 |
| Ligands IMD, GOL, EPE |
15, 24, NA |
NA, 108, 30 |
| Ions Cl-, SO42- |
1, 5 |
1, NA |
| Water |
146 |
573 |
| Wilson B-factor [Å 2] |
35.0 |
26.0 |
| Average B-factors [Å 2] |
||
| Overall |
27.5 |
20.9 |
| Protein |
27.6 |
20.6 |
| Ligands IMD, GOL, EPE |
37.0, 33.0, NA |
NA, 30.6, 62.7 |
| Ions Cl-, SO42- |
43.7, 55.5 |
30.7, NA |
| Water |
24.0 |
23.8 |
| R.m.s. Deviations |
||
| Bonds [Å] |
0.01 |
0.01 |
| Angles [°] |
1.13 |
1.33 |
| Coordinate error ESU (max. likelihood) |
0.26 |
0.21 |
| Correlation Coefficient |
||
| FOFC |
0.92 |
0.90 |
| FOFC free |
0.88 |
0.86 |
|
The numbers in parentheses are for the highest-resolution shell. | ||
Schormann et al. BMC Structural Biology 2007 7:45 doi:10.1186/1472-6807-7-45 |
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