1YDR
STRUCTURE OF CAMP-DEPENDENT PROTEIN KINASE, ALPHA-CATALYTIC SUBUNIT IN COMPLEX WITH H7 PROTEIN KINASE INHIBITOR 1-(5-ISOQUINOLINESULFONYL)-2-METHYLPIPERAZINE
Experimental procedure
| Detector technology | AREA DETECTOR |
| Detector | SIEMENS-NICOLET X100 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 73.580, 76.280, 80.580 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 6.000 - 2.200 |
| R-factor | 0.188 |
| Rwork | 0.188 |
| RMSD bond length | 0.016 * |
| RMSD bond angle | 2.200 * |
| Data reduction software | SAINT |
| Data scaling software | SAINT |
| Phasing software | X-PLOR |
| Refinement software | X-PLOR |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 6.000 * | |
| High resolution limit [Å] | 2.200 * | 2.200 * |
| Rmerge | 0.060 * | |
| Number of reflections | 14158 | |
| Completeness [%] | 63.0 | 32 * |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 5 * | 15 % METHANOL, 70 MILLIMOLAR SODIUM SULFATE, 20 MILLIMOLAR MES-BIS-TRIS PH 6.5, 279K USING HANGING DROP DIFFUSION., vapor diffusion - hanging drop |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 20 (mg/ml) | |
| 2 | 1 | drop | Mes-BisTris | 25 (mM) | |
| 3 | 1 | drop | 75 (mM) | ||
| 4 | 1 | drop | EDTA | 0.1 (mM) | |
| 5 | 1 | drop | dithiothreitol | 1 (mM) | |
| 6 | 1 | drop | octanoyl-N-methylglucamide | 1.5 (mM) | |
| 7 | 1 | drop | H inhibitor | 1.5 (mM) | |
| 8 | 1 | drop | PKI-(5-24) | 1 (mM) | |
| 9 | 1 | reservoir | methanol | 15 (%) |
