5L8O
crystal structure of human FABP6 in complex with cholate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-08-08 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.860, 64.720, 59.330 |
| Unit cell angles | 90.00, 94.02, 90.00 |
Refinement procedure
| Resolution | 59.180 - 2.390 |
| R-factor | 0.22896 |
| Rwork | 0.226 |
| R-free | 0.28139 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3elx |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.135 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.180 | 2.450 |
| High resolution limit [Å] | 2.390 | 2.390 |
| Rmerge | 0.077 | 0.754 |
| Number of reflections | 14115 | |
| <I/σ(I)> | 12 | 2.1 |
| Completeness [%] | 99.7 | 99.9 |
| Redundancy | 5.5 | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293.15 | 41% w/v PEG 3350 and 0.1 M Bis-tris pH 5.5 |
