9M2B
X-ray structure of human heart fatty acid-binding protein (apo-FABP3)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-11-11 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.800 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 70.576, 27.912, 58.403 |
| Unit cell angles | 90.00, 92.92, 90.00 |
Refinement procedure
| Resolution | 29.520 - 1.180 |
| R-factor | 0.1486 |
| Rwork | 0.146 |
| R-free | 0.18808 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.883 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.480 | 1.200 |
| High resolution limit [Å] | 1.180 | 1.180 |
| Rmerge | 0.110 | 0.553 |
| Number of reflections | 71921 | 3527 |
| <I/σ(I)> | 7.1 | 2 |
| Completeness [%] | 95.4 | |
| Redundancy | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.1M MES-NaOH(pH6.0), 30% PEG 3350, 3% Dioxane |
