3UCI
Crystal structure of Rhodostomin ARLDDL mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-07-09 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 26.221, 33.437, 73.253 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.350 |
R-factor | 0.14729 |
Rwork | 0.145 |
R-free | 0.18924 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1j2l |
RMSD bond length | 0.026 |
RMSD bond angle | 2.284 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.400 |
High resolution limit [Å] | 1.350 | 1.350 |
Rmerge | 0.055 | 0.559 |
Number of reflections | 14629 | |
<I/σ(I)> | 34.15 | 4.76 |
Completeness [%] | 99.0 | 100 |
Redundancy | 6.5 | 6.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.1M Tris-HCl, 0.8M sodium citrate tribasic dihydrate, 0.24M lithium sulfide, 0.5% glycerol, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |