1VEB
Crystal Structure of Protein Kinase A in Complex with Azepane Derivative 5
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 278 |
Detector technology | IMAGE PLATE |
Collection date | 2001-07-05 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 74.881, 76.510, 80.094 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 21.520 - 2.890 |
R-factor | 0.187 |
Rwork | 0.183 |
R-free | 0.25100 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.017 |
RMSD bond angle | 1.708 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 21.510 | 3.040 |
High resolution limit [Å] | 2.890 | 2.890 |
Number of reflections | 9625 | |
Completeness [%] | 89.9 | 79.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.4 | 278 | LiCl, MesBisTris, methanol, MEGA-8, pH 6.4, VAPOR DIFFUSION, HANGING DROP, temperature 278K |