1RMY
Crystal structure of AphA class B acid phosphatase/phosphotransferase ternary complex with deoxycytosine and phosphate bound to the catalytic metal
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE BW7A |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | BW7A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-03-11 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.05800 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 91.882, 66.393, 90.018 |
| Unit cell angles | 90.00, 119.66, 90.00 |
Refinement procedure
| Resolution | 30.570 - 1.750 |
| R-factor | 0.15647 |
| Rwork | 0.153 |
| R-free | 0.19361 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1n8n |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.497 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.580 | 1.840 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.075 | 0.328 |
| Number of reflections | 46824 | |
| <I/σ(I)> | 8.5 | 2.2 |
| Completeness [%] | 98.7 | 98 |
| Redundancy | 2.7 | 2.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 293 | AphA 6mg/mL, 50mM Na acetate, 25% PEG 6000, 10mM dCMP, pH 7.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
