1PZU
An asymmetric NFAT1-RHR homodimer on a pseudo-palindromic, Kappa-B site
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F1 |
| Synchrotron site | CHESS |
| Beamline | F1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2001-01-21 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9480 |
| Spacegroup name | P 21 21 21 |
| 格子定数 [Å] | 81.700, 122.900, 241.600 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 30.000 * - 3.100 |
| R因子 | 0.303 |
| Rwork | 0.296 |
| R-free | 0.31900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.010 * |
| 結合角の平均二乗偏差(RMSD) [度] | 1.500 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS (1.1) |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 30.000 * | 3.290 |
| 分解能 [Å] (高) | 3.100 | 3.100 |
| Rmerge_l_obs | 0.095 * | 0.308 * |
| Total number of observations | 124267 * | |
| 独立反射数 | 37145 * | 4269 * |
| 完全性 [%] | 82.4 * | 77 * |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | Vapor diffusion, hanging drop * | 6.3 * | 292 | HEPES, NaCl, glycerol, NH4OAc, MgCl2, spermine, PEG4000, Tris-HCl, pH 8.0, microbatch, temperature 292.0K |
結晶化試薬
| ID | 結晶ID | 濃度 | 試薬名 | 濃度 (単位) | 詳細 |
| 1 | 1 | 1 | HEPES | ||
| 10 | 1 | 2 | PEG4000 | ||
| 11 | 1 | 2 | spermine | ||
| 12 | 1 | 2 | NH4OAc | ||
| 13 | 1 | 2 | MgCl2 | ||
| 14 | 1 | 2 | glycerol | ||
| 15 | 1 | 2 | H2O | ||
| 2 | 1 | 1 | NaCl | ||
| 3 | 1 | 1 | glycerol | ||
| 4 | 1 | 1 | NH4OAc | ||
| 5 | 1 | 1 | MgCl2 | ||
| 6 | 1 | 1 | spermine | ||
| 7 | 1 | 1 | PEG4000 | ||
| 8 | 1 | 1 | Tris-HCl | ||
| 9 | 1 | 1 | H2O |
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 | reservoir | 100 (mM) | ||
| 2 | 1 | reservoir | 10 (mM) | ||
| 3 | 1 | reservoir | spermine | 2.5 (mM) | |
| 4 | 1 | reservoir | glycerol | 6 (%(v/v)) | |
| 5 | 1 | reservoir | PEG4000 | 6 (%(w/v)) | |
| 6 | 1 | reservoir | Bis-Tris propane | 50 (mM) | pH6.3 |
