4F40
X-ray crystal structure of Apo prostaglandin f synthase from Leishmania major Friedlin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.1 |
Synchrotron site | ALS |
Beamline | 5.0.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-04-21 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.977408 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 94.550, 34.590, 107.200 |
Unit cell angles | 90.00, 103.22, 90.00 |
Refinement procedure
Resolution | 46.190 - 1.600 |
R-factor | 0.1551 |
Rwork | 0.154 |
R-free | 0.18020 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1vbj |
RMSD bond length | 0.014 |
RMSD bond angle | 1.540 |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (dev_1048) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.640 | |
High resolution limit [Å] | 1.600 | 7.160 | 1.600 |
Rmerge | 0.083 | 0.022 | 0.578 |
Number of reflections | 89147 | 1107 | 5975 |
<I/σ(I)> | 13.33 | 34.43 | 2.37 |
Completeness [%] | 98.7 | 98.6 | 90.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 289 | 0.1 M sodium citrate, pH 5.50, 20% PEG3000, VAPOR DIFFUSION, SITTING DROP, temperature 289K |