5EDB
human fatty acid binding protein 4 in complex with 6-Chloro-2-methyl-4-phenyl-quinoline-3-carboxylic acid at 1.18A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2010-06-25 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.000000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 32.297, 54.025, 75.462 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.700 - 1.180 |
Rwork | 0.148 |
R-free | 0.17730 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | REFMAC |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 43.930 | 1.210 | |
High resolution limit [Å] | 1.180 | 5.260 | 1.180 |
Rmerge | 0.044 | 0.027 | 0.558 |
Rmeas | 0.048 | 0.030 | 0.631 |
Total number of observations | 272461 | ||
Number of reflections | 44284 | 587 | 2932 |
<I/σ(I)> | 18.31 | 47.12 | 2.62 |
Completeness [%] | 98.7 | 98 | 89.5 |
Redundancy | 6.13 | ||
CC(1/2) | 0.999 | 0.998 | 0.839 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.1 M HEPES/NaOH pJ 7.5, 2-2.2 M ammonium sulfate |