1CHZ
A NEW NEUROTOXIN FROM BUTHUS MARTENSII KARSCH
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 293 |
| Spacegroup name | P 21 21 21 |
| 格子定数 [Å] | 36.640, 37.310, 37.950 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 20.000 - 1.760 |
| R因子 | 0.19 * |
| Rwork | 0.190 |
| R-free | 0.24800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1snb |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.015 |
| 結合角の平均二乗偏差(RMSD) [度] | 26.850 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | X-PLOR |
| Refinement software | X-PLOR (3.851) |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 20.000 | 1.820 |
| 分解能 [Å] (高) | 1.760 | 1.760 |
| Rmerge_l_obs | 0.100 | 0.340 * |
| Total number of observations | 11634 * | |
| 独立反射数 | 5004 | |
| 完全性 [%] | 90.0 | 55.3 |
| 冗長性 | 2.4 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | Vapor diffusion, hanging drop * | 7.5 | pH 7.5 |
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 | acetate | 10 (mM) | |
| 2 | 1 | drop | protein | 10 (mg/ml) | |
| 3 | 1 | reservoir | MPD | 65-70 (%) | |
| 4 | 1 | reservoir | Tris | 0.1 (M) | |
| 5 | 1 | reservoir | dioxane | 5 (%) |
