4RQG
Crystal structure of Rhodostomin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13C1 |
Synchrotron site | NSRRC |
Beamline | BL13C1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-04-15 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.00000 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 93.956, 34.179, 53.946 |
Unit cell angles | 90.00, 119.26, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.660 |
R-factor | 0.16268 |
Rwork | 0.160 |
R-free | 0.20786 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3uci |
RMSD bond length | 0.027 |
RMSD bond angle | 2.173 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | |
High resolution limit [Å] | 1.600 | 1.660 |
Number of reflections | 17798 | |
<I/σ(I)> | 15.9 | |
Completeness [%] | 95.8 | 90.1 |
Redundancy | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 293 | 50mM MOPS, 32% PEG1500, 5% PEG200, pH 7.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K |