5HZ5
FABP5 in complex with 6-Chloro-4-phenyl-2-piperidin-1-yl-3-(1H-tetrazol-5-yl)-quinoline
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 | 2011-02-01 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.000000 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 62.790, 62.790, 75.350 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.399 - 1.400 |
R-factor | 0.2089 |
Rwork | 0.208 |
R-free | 0.22770 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | REFMAC |
Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.240 | 1.440 | |
High resolution limit [Å] | 1.400 | 6.260 | 1.400 |
Rmerge | 0.115 | 0.047 | 2.214 |
Number of reflections | 29968 | ||
<I/σ(I)> | 15.12 | 47.59 | 0.84 |
Completeness [%] | 98.8 | 100 | 97.4 |
Redundancy | 13 | 13.8 | |
CC(1/2) | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 |