4G8Y
Crystal structure of Ribonuclease A in complex with 5b
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-11-21 |
Detector | AGILENT ATLAS CCD |
Wavelength(s) | 1.54178 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 100.301, 32.672, 72.380 |
Unit cell angles | 90.00, 89.35, 90.00 |
Refinement procedure
Resolution | 13.884 - 1.800 |
R-factor | 0.2018 |
Rwork | 0.199 |
R-free | 0.25700 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2g8q |
RMSD bond length | 0.006 |
RMSD bond angle | 1.165 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | REFMAC |
Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 22087 | |
<I/σ(I)> | 12.4 | 2.8 |
Completeness [%] | 99.7 | 99.7 |
Redundancy | 7.12 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 289 | 25% PEG 4000, 20 mM Nacitrate, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K |