1SVE
Crystal Structure of Protein Kinase A in Complex with Azepane Derivative 1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 278 |
| Detector technology | AREA DETECTOR |
| Collection date | 2001-06-29 |
| Detector | SIEMENS X1000 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 74.240, 76.320, 79.740 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.940 - 2.490 |
| R-factor | 0.202 |
| Rwork | 0.199 |
| R-free | 0.25700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.477 |
| Data reduction software | ASTRO |
| Data scaling software | SAINT |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.930 | 2.570 |
| High resolution limit [Å] | 2.490 | 2.500 |
| Number of reflections | 14845 | |
| Completeness [%] | 91.1 | 54 |
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 |
