4ZK7
Crystal structure of rescued two-component self-assembling tetrahedral cage T33-31
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-04-03 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.94200 |
| Spacegroup name | P 21 21 21 |
| 格子定数 [Å] | 121.100, 128.400, 204.700 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 分解能 | 88.100 - 3.400 |
| R因子 | 0.192 |
| Rwork | 0.190 |
| R-free | 0.23880 |
| 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] | 1.200 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.5.6) |
| Refinement software | BUSTER (2.10.0) |
Quality characteristics
| Overall | Inner shell | Outer shell | |
| 分解能 [Å] (低) | 88.100 | 88.100 | 3.330 |
| 分解能 [Å] (高) | 3.250 | 14.530 | 3.250 |
| Rmerge_l_obs | 0.205 | 0.061 | 0.606 |
| Rmeas | 0.233 | 0.069 | 0.777 |
| Total number of observations | 198097 | ||
| 独立反射数 | 49099 | 577 | 2485 |
| <I/σ(I)> | 5.54 | 15.9 | 1.2 |
| 完全性 [%] | 96.3 | 87.8 | 66.8 |
| 冗長性 | 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 | 298 | 100 mM HEPES pH 7.5, 9% (w/v) PEG 8000, 11.7% (v/v) ethylene glycol |
