8HSF
Insulin triple mutant INS-RQD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | RRCAT INDUS-2 BEAMLINE PX-BL21 |
Synchrotron site | RRCAT INDUS-2 |
Beamline | PX-BL21 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2022-05-11 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 0.978 |
Spacegroup name | H 3 |
Unit cell lengths | 79.860, 79.860, 38.890 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 33.900 - 2.900 |
R-factor | 0.2594 |
Rwork | 0.258 |
R-free | 0.28310 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 0.476 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1-4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.900 | 3.060 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmeas | 0.077 | 0.493 |
Rpim | 0.038 | 0.236 |
Total number of observations | 7847 | 1216 |
Number of reflections | 2056 | 319 |
<I/σ(I)> | 10.8 | 2.4 |
Completeness [%] | 99.6 | |
Redundancy | 3.8 | 3.8 |
CC(1/2) | 0.995 | 0.844 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 1M Imidazole |