4WYP
The crystal structure of the A109G mutant of RNase A in complex with 5'AMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2012-03-07 |
Detector | MAR scanner 300 mm plate |
Wavelength(s) | 0.987 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 76.776, 51.725, 58.158 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.038 - 1.502 |
R-factor | 0.1526 |
Rwork | 0.151 |
R-free | 0.18560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4wyn |
RMSD bond length | 0.010 |
RMSD bond angle | 1.297 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.530 |
High resolution limit [Å] | 1.500 | 4.070 | 1.500 |
Rmerge | 0.142 | 0.177 | 0.434 |
Rmeas | 0.158 | 0.197 | 0.488 |
Rpim | 0.068 | 0.085 | 0.220 |
Total number of observations | 169142 | ||
Number of reflections | 35457 | ||
<I/σ(I)> | 15.4 | ||
Completeness [%] | 94.6 | 96 | 87 |
Redundancy | 4.8 | 4.7 | 4.5 |
CC(1/2) | 0.965 | 0.873 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 294 | MIB Buffer, PEG 6,000 |