6T7N
Trypanosoma cruzi farnesyl diphosphate synthase in complex with IPP and Mn
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-22 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.893174 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 58.450, 58.450, 391.793 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.010 - 1.900 |
R-factor | 0.1752 |
Rwork | 0.173 |
R-free | 0.20760 |
Structure solution method | SAD |
RMSD bond length | 0.009 |
RMSD bond angle | 0.944 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | SHELXDE |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.010 |
High resolution limit [Å] | 1.900 | 1.900 |
Number of reflections | 58433 | 8979 |
<I/σ(I)> | 35.46 | 2.69 |
Completeness [%] | 98.9 | |
Redundancy | 4.9 | |
CC(1/2) | 1.000 | 0.873 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | 4mM ZnSO4+ 8 mM MES pH:6.50, 12.36% PEG MME 550, 11.57% Glycerol. crystal obtained by microseeding: 160mM (NH4)2SO4, 80mM NaOAc pH:5.00, 20% PEG 4000, 20% Glycerol. |