6AQ1
The crystal structure of human FABP3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-03-10 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 0.97931 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 43.504, 52.904, 55.510 |
Unit cell angles | 90.00, 97.45, 90.00 |
Refinement procedure
Resolution | 19.542 - 1.400 |
R-factor | 0.171525378539 |
Rwork | 0.170 |
R-free | 0.19791 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1hms |
RMSD bond length | 0.005 |
RMSD bond angle | 0.781 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.390 | 1.480 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.060 | 0.318 |
Rpim | 0.033 | 0.174 |
Number of reflections | 47516 | 6777 |
<I/σ(I)> | 14 | 4.4 |
Completeness [%] | 96.6 | 95 |
Redundancy | 4.3 | 4.3 |
CC(1/2) | 0.998 | 0.895 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M sodium cacodylate, pH 7.0, 2.3 M ammonium sulfate |