3IRB
Crystal structure of protein with unknown function from DUF35 family (13815350) from SULFOLOBUS SOLFATARICUS at 1.80 A resolution
Replaces: 2GNRExperimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL11-1 |
| Synchrotron site | SSRL |
| Beamline | BL11-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-03-03 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.918370,0.979386,0.979170 |
| Spacegroup name | P 41 2 2 |
| Unit cell lengths | 75.170, 75.170, 115.400 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.939 - 1.800 |
| R-factor | 0.171 |
| Rwork | 0.169 |
| R-free | 0.20000 |
| Structure solution method | MAD |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.408 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SHELX |
| Refinement software | REFMAC (5.5.0099) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 26.939 | 26.939 | 1.860 |
| High resolution limit [Å] | 1.800 | 3.870 | 1.800 |
| Rmerge | 0.081 | 0.031 | 0.792 |
| Number of reflections | 31362 | 5928 | 5114 |
| <I/σ(I)> | 9.73 | 30.1 | 1.9 |
| Completeness [%] | 99.2 | 99.3 | 93 |
| Redundancy | 7.056 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 277 | 2.0M (NH4)2SO4, 0.1M Acetate pH 4.6, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
