Table of refinement parameters for DrrD
August 2000
| |
Model from Exp. Map
|
SA-I
|
Grouped B
|
Rebuild, SA-II
|
Individual B
|
Add Waters
|
|
| Input Filename |
r1
|
r2
|
r3
|
r4
|
r5
|
r6
|
|
| Rwork |
0.356
|
0.304
|
0.273
|
0.263
|
0.256
|
0.225
|
|
| Rfree |
0.358
|
0.311
|
0.282
|
0.285
|
0.277
|
0.249
|
|
| cv-Luzzatti coord error |
0.46 A
|
0.37 A
|
0.33 A
|
0.34 A
|
0.33 A
|
0.29 A
|
|
| cv-Sigmaa coord error |
0.33 A
|
0.17 A
|
-0.01 A
|
0.02 A
|
0.06 A
|
0.11 A
|
|
| rmsd bonds |
0.032
|
0.0082
|
0.0082
|
0.0073
|
0.0073
|
0.0073
|
|
| rmsd angles |
3.6
|
1.3
|
1.3
|
1.25
|
1.25
|
1.25
|
|
| Avg B |
20.0
|
20.0
|
15.4
|
15.7
|
15.4
|
16.2
|
|
| Min B |
20.0
|
20.0
|
3.6
|
3.6
|
4.6
|
4.6
|
|
| Max B |
20.0
|
20.0
|
48
|
48
|
45.3
|
48.9
|
|
| rmsd B-mc |
0.0
|
0.0
|
1.8
|
1.8
|
1.2
|
1.8
|
|
| rmsd B-sc |
0.0
|
0.0
|
3.6
|
3.6
|
2.2
|
3.1
|
|
| |
|
|
|
|
|
|
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