6I1P
Respiratory complex I from Thermus thermophilus with bound NADH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-05-12 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.900 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 96.110, 341.450, 263.890 |
| Unit cell angles | 90.00, 100.52, 90.00 |
Refinement procedure
| Resolution | 58.712 - 3.207 |
| R-factor | 0.219 |
| Rwork | 0.210 |
| R-free | 0.23100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4hea |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.996 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.13rc1_2961: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 58.712 | 3.370 |
| High resolution limit [Å] | 3.200 | 3.200 |
| Rmerge | 0.157 | 2.644 |
| Rpim | 0.112 | 1.911 |
| Number of reflections | 260997 | 35816 |
| <I/σ(I)> | 5.3 | 0.5 |
| Completeness [%] | 95.5 | 90.1 |
| Redundancy | 2.7 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 296 | 100 mM Bis-Tris pH 6.0, 23% (w/v) PEG 4000, 100 mM KCl, 100 mM glutaric acid pH 6.0 and 0.01 mM n-tetradecyl-beta-D-maltopyranoside |
