6BPR
Crystal structure of cysteine, nitric oxide-bound ferrous form of the uncrosslinked F2-Tyr157 human cysteine dioxygenase
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-10-13 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.97919 |
Spacegroup name | P 65 |
格子定数 [Å] | 131.306, 131.306, 34.175 |
格子定数 [度] | 90.00, 90.00, 120.00 |
精密化法
残基 | 32.827 - 1.960 |
R因子 | 0.1628 |
Rwork | 0.161 |
R-free | 0.18800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ic1 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX |
Quality characteristics
Overall | Inner shell | Outer shell | |
分解能 [Å] (低) | 50.000 | 50.000 | 1.990 |
分解能 [Å] (高) | 1.960 | 5.320 | 1.960 |
Rmerge_l_obs | 0.143 | 0.058 | 0.999 |
Total number of observations | 273552 | ||
独立反射数 | 24681 | 1326 | 1224 |
<I/σ(I)> | 5 | ||
完全性 [%] | 100.0 | 99.7 | 100 |
冗長性 | 11.1 | 10.2 | 11 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 295 | 0.1 M MES, 2 M ammonium sulfate, 2% PEG400 |