1SNB
STRUCTURE OF SCORPION NEUROTOXIN BMK M8
Experimental procedure
Temperature [K] | 293 |
Detector technology | AREA DETECTOR |
Collection date | 1991-12-14 |
Detector | SIEMENS |
Spacegroup name | P 1 21 1 |
格子定数 [Å] | 23.320, 38.560, 29.150 |
格子定数 [度] | 90.00, 107.48, 90.00 |
精密化法
残基 | 8.000 - 1.900 |
R因子 | 0.181 |
Rwork | 0.181 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | AAH II |
結合長の平均二乗偏差(RMSD) [Å] | 0.016 |
結合角の平均二乗偏差(RMSD) [度] | 26.040 * |
Data reduction software | XENGEN |
Data scaling software | XENGEN |
Phasing software | X-PLOR |
Refinement software | X-PLOR |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 1.950 | |
分解能 [Å] (高) | 1.850 | 1.850 |
Rmerge_l_obs | 0.052 | 0.118 |
Total number of observations | 6130 * | |
独立反射数 | 3802 | |
<I/σ(I)> | 10.2 | 4.59 |
完全性 [%] | 88.4 | 17.3 |
冗長性 | 1.6 | 1.15 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | Vapor diffusion, sitting drop * | 4.55 * |
文献の結晶化試薬
ID | 結晶ID | 溶液 | 試薬名 | 濃度 (単位) (単位) | 詳細 |
1 | 1 | drop | protein | 20 (mg/ml) | |
2 | 1 | drop | 0.02 (M) | ||
3 | 1 | drop | 0.2 (M) |