6N86
Resistance to inhibitors of cholinesterase 8A (Ric8A) protein
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 4.2.2 |
| Synchrotron site | ALS |
| Beamline | 4.2.2 |
| Temperature [K] | 100 |
| Detector technology | CMOS |
| Collection date | 2018-02-15 |
| Detector | RDI CMOS_8M |
| Wavelength(s) | 1 |
| Spacegroup name | F 2 2 2 |
| 格子定数 [Å] | 95.150, 134.340, 221.750 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 57.450 - 3.900 |
| R因子 | 0.2583 |
| Rwork | 0.257 |
| R-free | 0.29610 |
| Structure solution method | MOLECULAR REPLACEMENT |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.001 |
| 結合角の平均二乗偏差(RMSD) [度] | 0.392 |
| Data reduction software | XDS |
| Data scaling software | SCALA (3.3.22) |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.14_3260: ???)) |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 57.450 | 4.110 |
| 分解能 [Å] (高) | 3.900 | 3.900 |
| Rmerge_l_obs | 0.097 | 0.799 |
| Rmeas | 0.107 | 0.867 |
| Rpim | 0.028 | 0.237 |
| 独立反射数 | 6668 | 954 |
| <I/σ(I)> | 18.4 | 3.3 |
| 完全性 [%] | 99.9 | 100 |
| 冗長性 | 14.3 | 13.3 |
| CC(1/2) | 0.999 | 0.955 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277 | 0.1 M Bis-Tris propane, 0.2 M NaI, 12-20 % PEG3350, seeding |
