1U6R
Transition state analog complex of muscle creatine kinase (R134K) mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-11-01 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.689, 92.572, 165.553 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.000 - 1.650 |
| R-factor | 0.16673 |
| Rwork | 0.165 |
| R-free | 0.20017 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1crk |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.214 |
| Data reduction software | HKL-2000 |
| Data scaling software | CCP4 ((TRUNCATE)) |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.000 | 1.694 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Number of reflections | 88822 | |
| Completeness [%] | 84.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 20% PEG 8K, 25 mM ammonium acetate, 25 mM sodium nitrate and 0.1 M sodium cacodylate, pH 6.5., VAPOR DIFFUSION, HANGING DROP, temperature 293K |
