3NEW
p38-alpha complexed with Compound 10
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-BM |
Synchrotron site | APS |
Beamline | 17-BM |
Spacegroup name | P 21 21 21 |
格子定数 [Å] | 64.907, 74.477, 77.885 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 49.880 - 2.510 |
R因子 | 0.219 |
Rwork | 0.214 |
R-free | 0.30600 |
Structure solution method | MOLECULAR REPLACEMENT |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | REFMAC |
Quality characteristics
Overall | |
分解能 [Å] (低) | 49.880 |
分解能 [Å] (高) | 2.510 |
独立反射数 | 12654 |
完全性 [%] | 99.0 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | 8 | 291 | 30 mg/mL protein in 25 mM Tris pH 8, 100 mM NaCl, 10% glycerol, and 10 mM DTT co-crystallized with 1 mM Compound 10 in 20% PEG 2000MME and 0.1 M Bis-Tris pH 6.5 at 18 C., VAPOR DIFFUSION, HANGING DROP, temperature 291K |